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Ligand

NameCHEMBL3752716
Molecular formulaC27H36N6O4
IUPAC nameN-[(2S)-1-[[(2S,3S)-1-(1H-benzimidazol-2-ylmethylamino)-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight508.623
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP4.6
SynonymsN/A
Inchi KeyAYWJKYHALCJUMS-JBUDQFAYSA-N
Inchi IDInChI=1S/C27H36N6O4/c1-3-17(2)24(27(36)28-16-23-30-19-11-7-8-12-20(19)31-23)33-25(34)21(15-18-9-5-4-6-10-18)32-26(35)22-13-14-29-37-22/h7-8,11-14,17-18,21,24H,3-6,9-10,15-16H2,1-2H3,(H,28,36)(H,30,31)(H,32,35)(H,33,34)/t17-,21-,24-/m0/s1
PubChem CID56640475
ChEMBLCHEMBL3752716
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522007Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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