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Name | CHEMBL350151 |
---|---|
Molecular formula | C35H44N6O3 |
IUPAC name | N-[1-[[2-(dimethylamino)acetyl]-[(2-methoxyphenyl)methyl]amino]-3-(1H-indol-3-yl)propan-2-yl]-2-(4-phenylpiperazin-1-yl)acetamide |
Molecular weight | 596.776 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 4.4 |
Synonyms | BDBM50049313 2-Dimethylamino-N-{3-(1H-indol-3-yl)-2-[2-(4-phenyl-piperazin-1-yl)-acetylamino]-propyl}-N-(2-methoxy-benzyl)-acetamide |
Inchi Key | BPOJDIXXCVFYFB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H44N6O3/c1-38(2)26-35(43)41(23-27-11-7-10-16-33(27)44-3)24-29(21-28-22-36-32-15-9-8-14-31(28)32)37-34(42)25-39-17-19-40(20-18-39)30-12-5-4-6-13-30/h4-16,22,29,36H,17-21,23-26H2,1-3H3,(H,37,42) |
PubChem CID | 10627355 |
ChEMBL | CHEMBL350151 |
IUPHAR | N/A |
BindingDB | 50049313 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
29724 | Substance-P receptor | P25103 | TACR1 | Homo sapiens (Human) | 407 |
29725 | Substance-P receptor | P30548 | Tacr1 | Mus musculus (Mouse) | 407 |
29726 | Substance-P receptor | P14600 | Tacr1 | Rattus norvegicus (Rat) | 407 |
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