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 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

You can:

Ligand

NameSC 19220
Molecular formulaC16H14ClN3O3
IUPAC nameN'-acetyl-3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide
Molecular weight331.756
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.3
SynonymsCTK8G3065
J-012559
MolPort-003-959-528
NCGC00025038-01
SC-19220
[ Show all ]
Inchi KeyKNURFLJTOUGOOQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H14ClN3O3/c1-10(21)18-19-16(22)20-9-11-4-2-3-5-14(11)23-15-7-6-12(17)8-13(15)20/h2-8H,9H2,1H3,(H,18,21)(H,19,22)
PubChem CID4336830
ChEMBLCHEMBL112816
IUPHAR1922
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
173715D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
173714Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
554153Prostaglandin E2 receptor EP1 subtypeP70597Ptger1Rattus norvegicus (Rat)405
554154Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
173713Prostaglandin E2 receptor EP3 subtypeP34979PTGER3Bos taurus (Bovine)417

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