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Name | CHEMBL1682673 |
---|---|
Molecular formula | C31H35Cl2N3O3S |
IUPAC name | (1S,2R)-N-benzyl-1-(3,4-dichlorophenyl)-2-[[4-(methanesulfonamido)-4-phenylpiperidin-1-yl]methyl]-N-methylcyclopropane-1-carboxamide |
Molecular weight | 600.599 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | BDBM50337408 SCHEMBL2477209 (1S,2R)-N-benzyl-1-(3,4-dichlorophenyl)-N-methyl-2-((4-(methylsulfonamido)-4-phenylpiperidin-1-yl)methyl)cyclopropanecarboxamide |
Inchi Key | BKYRIMQMIWLUBG-SUYBVONHSA-N |
Inchi ID | InChI=1S/C31H35Cl2N3O3S/c1-35(21-23-9-5-3-6-10-23)29(37)31(25-13-14-27(32)28(33)19-25)20-26(31)22-36-17-15-30(16-18-36,34-40(2,38)39)24-11-7-4-8-12-24/h3-14,19,26,34H,15-18,20-22H2,1-2H3/t26-,31+/m0/s1 |
PubChem CID | 53317093 |
ChEMBL | CHEMBL1682673 |
IUPHAR | N/A |
BindingDB | 50337408 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
26279 | Neuromedin-K receptor | P29371 | TACR3 | Homo sapiens (Human) | 465 |
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