Zhang Lab

University of Michigan

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●DMFold ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	Salbutamol
Molecular formula	C13H21NO3
IUPAC name	4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
Molecular weight	239.315
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	0.3
Synonyms	KBio1_000943 559S949 Salbron KUC106739N AB1006817 D0K5CB m-Xylene-.alpha.,.alpha.'-diol, .alpha.'-((tert-butylamino)methyl)-4-hydroxy- AH 3365 Salbutamol, British Pharmacopoeia (BP) Reference Standard DSSTox_CID_1255 Mozal Albuterol [USAN:USP] Salbutard EU-0101090 NCGC00015955-11 Alpha-[(t-Butylamino)methyl]-4-hydroxy-m-xylene-alpha,alpha-diol Salvent HMS2089I19 NCGC00024698-05 Asmadil SCHEMBL4913 (+-)-Salbutamol NSC757417 Asthalin Spectrum2_001350 1,3-Benzenedimethanol, .alpha.1-[[(1,1-dimethylethyl)amino]methyl]-4-hydroxy- Prestwick2_000198 Bio1_001424 SR-01000075161-4 2-(tert-Butylamino)-1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanol Proventil HFA Bronter HMS3712H17 4-[(1S)-2-(butylamino)-1-hydroxy-isopropyl]-2-(hydroxymethyl)phenol Respolin Butovent to_000081 Ventodisks Volma Sultanol N Sabutal CAS-18559-94-9 KBio2_005816 AB00052154-08 Salbuhexal Combivent Libretin AC1Q1MO0 Salbutamol Free Base Dilatamol m-Xylene-alpha,alpha'-diol, alpha-((tert-butylamino)methyl)-4-hydroxy- albuterol Salbutamol,(+/-) DTXSID5021255 NCGC00015955-06 Almotex Salbuven Gerivent NCGC00015955-14 AN-18804 SBI-0051060.P005 NCGC00258354-01 Asmatol SMP1_000268 PDSP2_000620 BCBcMAP01_000116 Spectrum_000200 1,3-Benzenedimethanol, alpha1-(((1,1-dimethylethyl)amino)methyl)-4-hydroxy- ProAi (TN) BRD-A88254928-001-04-6 35763-26-9 Q-201696 Bumol HY-B1037 4-[2-(tert-Butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol # Venetlin (Salt/Mix) Ventolin Inhaler VU0243312-5 ST024764 Theosal 4-{2-[(tert-butyl)amino]-1-hydroxyethyl}-2-(hydroxymethyl)phenol Salamol EB Cetsim KS-5209 AB00052154_11 Salbusian CTK8E5622 LS-29861 Aerolin Salbutamol Sulphate DL-N-tert-Butyl-2-(4-hydroxy-3-hydroxymethylphenyl)-2-hydroxyethylamine MFCD00148978 ALBUTEROL SULFATE Salbutamolum [INN-Latin] EINECS 242-424-0 NCGC00015955-09 alpha-[(t-Butylamino)methyl]-4-hydroxy-m-xylene-alpha,alpha -diol Salmaplon HMS1568H17 NCGC00024698-03 API0006973 SCH-13949W (+-)-Albuterol Novosalmol Asmol SPBio_002076 .alpha.1-[(tert-Butylamino)methyl]-4-hydroxy-m-xylene-.alpha.,.alpha.'-diol Prestwick0_000198 Bio1_000446 SR-01000075161-11 18559-94-9 Proventil Broncho-Spray HMS2092I08 4-Hydroxy-3-hydroxymethyl-alpha-((tert-butylamino)methyl)benzyl alcohol racemic-Salbutamol Butohaler J10176 Ventilan Volare albuterol HFA ST24042831 Tox21_110266_1 Buventol KBio2_000680 A812971 Salbu-BASF CHEMBL714 L000531 AC-10286 Salbutamol (Albuterol) m-Xylene-.alpha.,.alpha.-diol, .alpha.-1-((tert-butylamino)methyl)-4-hydroxy- Airomir Salbutamol, European Pharmacopoeia (EP) Reference Standard DSSTox_GSID_21255 NCGC00015955-04 Albuterol [USAN] Salbutine Farcolin NCGC00015955-12 alpha-[(tert-Butylamino)methyl]-4-hydroxy-m-xylene-alpha,alpha'-diol Saventol NCGC00024698-06 Asmanil Servitamol (alpha1-((tert-butylamino)methyl)-4-hydroxy-m-xylene-alpha,alpha-diol) Parasma Asthalin (TN) Spectrum4_000887 1,3-Benzenedimethanol, alpha(sup 1)-(((1,1-dimethylethyl)amino)methyl)-4-hydroxy- Prestwick3_000198 BIS7017 2-t-Butylamino-1-(4-hydroxy-3-hydroxy-3-hydroxymethyl)phenylethanol Proventil Inhaler BSPBio_000155 HMS502P05 4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol Rotahaler TR-008568 Ventolin Volmax SR-01000075161-5 Suprasma Sabutamol CC-23825 KBioGR_001294 AB00052154-09 Salbulin CS-4556 Lopac0_001090 AccuNeb Salbutamol impurity I (1RS)-2-[(1,1-dimethylethyl) DivK1c_000943 MCULE-4493408325 ALBUTEROL (+/-) Salbutamol-d9 EC 242-424-0 NCGC00015955-07 alpha'-((tert-Butylamino)methyl)-4-hydroxy-m-xylene-alpha,alpha'-diol Salbuvent Grafalin NCGC00015955-16 AN-7048 SC-22638 NDAUXUAQIAJITI-UHFFFAOYSA-N Asmaven Solbutamol .alpha.'-((tert-Butylamino)methyl)-4-hydroxy-m-xylene-.alpha.,.alpha.'-diol Pharmakon1600-01500677 BCP28423 Spreor 1-(tert-Butylaminomethyl)-4-hydroxy-m-xylene-.alpha.1,.alpha.3-diol ProAir BRD-A88254928-001-05-3 4-(2-(tert-Butylamino)-1-hydroxyethyl)-2-(hydroxymethyl)phenol R,S-Albuterol Butamol I06-0331 4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol Ventalin inhaler Ventolin Rotacaps Zaperin ST075204 Tobybron Salbetol CHEBI:2549 KSC-11-222-1 AB0011383 Salbutalan D02147 LS-7693 Aerolin (TN) Salbutamol [INN:BAN] dl-Salbutamol MolPort-001-838-925 Albuterol Sulphate Salbutan Eolene NCGC00015955-10 alpha-[(t-Butylamino)methyl]-4-hydroxy-m-xylene-alpha,alpha'-diol Salomol HMS1921C04 NCGC00024698-04 Arubendol-Salbutamol SCHEMBL10025126 (+-)-alpha(sup 1)-(((1,1-Dimethylethyl)amino)methyl)-4-hydroxy-1,3-benzenedimethanol NSC-757417 Asmol Uni-Dose SPECTRUM1500677 1,3-Benzenedimethanol, .alpha.(1)-[[(1,1-dimethylethyl)amino]methyl]-4-hydroxy- Prestwick1_000198 Bio1_000935 SR-01000075161-3 2-(tert-Butylamino)-1-(4-hydroxy-3-hydroxymethylphenyl)ethanol Proventil (TN) Broncovaleas HMS2095H17 4-[(1S)-1-hydroxy-2-(propylamino)ethyl]-2-(hydroxymethyl)phenol, oxamethane Respax Butotal K-5595 Tox21_200800 Ventiloboi Volare easi-breathe Sultanol C-14301 KBio2_003248 AB00052154 Salbu-Fatol Cobutolin Levosalbutamol Hydrochloride AC1L1CVO Salbutamol 100 microg/mL in Acetonitrile DB01001 m-Xylene-alpha,alpha'-diol, alpha'-((tert-butylamino)methyl)-4-hydroxy- AKOS007930174 Salbutamol, VETRANAL(TM), analytical standard DSSTox_RID_76042 NCGC00015955-05 Albuterol, United States Pharmacopeia (USP) Reference Standard Salbutol FT-0630453 NCGC00015955-13 Alti-Salbutamol SBB066105 NCGC00024698-07 Asmasal SGCUT00011 (l)-albuterol PDSP1_000623 AX8136202 Spectrum5_001059 1,3-Benzenedimethanol, alpha(sup 1)-(((1,1-dimethylethyl)amino)methyl)-4-hydroxy-, (+-)- Prestwick_665 BPBio1_000171 Q-201695 Bugonol HSDB 7206 4-[2-(tert-Butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol S 8260 Vencronyl Ventolin (TN) Vospire SR-01000075161-8 Suxar 4-{2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl}-2-(hydroxymethyl)phenol Salamol CCG-39288 KBioSS_000680 AB00052154_10 Salbupur CS0015 Lopac0_001098 ACM35763269 Salbutamol sulfate dl-Albuterol Medolin Albuterol (USP) Salbutamolum Ecovent NCGC00015955-08 alpha(sup 1)-((tert-Butylamino)methyl)-4-hydroxy-m-xylene-alpha,alpha'-diol Sallbupp GTPL558 NCGC00024698-02 Anebron SC-93513 NINDS_000943 Asmidon SPBio_001539 .alpha.1'-[[(1,1-Dimethylethyl)amino]methyl]-4-hydroxy-1,3-benzenedimethanol, hemisulfate Pneumolat BDBM25769 SR-01000075161 1-(tert-Butylaminomethyl)-4-hydroxy-m-xylene-alpha1,alpha3-diol Proair HFA BRN 2213614 4-Hydroxy-3-hydroxymethyl-.alpha.-((tert-butylamino)methyl)benzyl alcohol racemic salbutamol Buto-Asma IDI1_000943 Ventamol Ventoline ZX-AFC000812 ST077150 Tox21_110266 [ Show all ]
Inchi Key	NDAUXUAQIAJITI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3
PubChem CID	2083
ChEMBL	CHEMBL714
IUPHAR	558
BindingDB	25769
DrugBank	DB01001
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
220387	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
220385	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
220386	Beta-2 adrenergic receptor	Q8K4Z4	Adrb2	Cavia porcellus (Guinea pig)	418
220388	Beta-2 adrenergic receptor	Q28044	ADRB2	Bos taurus (Bovine)	418
220384	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408
490272	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218