Home Research Services Publications People Teaching Job Opening Facilities News Forum Lab Only
Online Services

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH BSpred SVMSEQ ANGLOR BSP-SLIM SAXSTER ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER BindProf BindProfX ResQ IonCom STRUM DAMpred

TM-score TM-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR NeBcon WDL-RF ATPbind DockRMSD

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

You can:

Ligand

NameCHEMBL52438
Molecular formulaC19H25NO
IUPAC nameN,N-dipropyl-2,3-dihydro-1H-benzo[f]chromen-2-amine
Molecular weight283.415
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP5.1
Synonyms(2,3-Dihydro-1H-benzo[f]chromen-2-yl)-dipropyl-amine
BDBM50036853
Inchi KeyDKPLHRMZPXJGSC-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H25NO/c1-3-11-20(12-4-2)16-13-18-17-8-6-5-7-15(17)9-10-19(18)21-14-16/h5-10,16H,3-4,11-14H2,1-2H3
PubChem CID10265863
ChEMBLCHEMBL52438
IUPHARN/A
BindingDB50036853
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Total entries: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
625105-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
625065-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
625115-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
62512Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
62508Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
62507D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
62509D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444

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