General Information of the Compound
| Compound ID |
CP0388756
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(cyclopropylmethyl)-3-methyl-N-(oxolan-2-ylmethyl)-4-phenylbenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H27NO2
|
||||||||||||||||||
| Molecular Weight |
349.474
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc(ccc1-c1ccccc1)C(=O)N(CC1CC1)CC1CCCO1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H27NO2/c1-17-14-20(11-12-22(17)19-6-3-2-4-7-19)23(25)24(15-18-9-10-18)16-21-8-5-13-26-21/h2-4,6-7,11-12,14,18,21H,5,8-10,13,15-16H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
HDBSZQAXQQMBHC-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01658, Oxytocin receptor
Protein ID: PT01839, Vasopressin V1a receptor
Protein ID: PT01840, Vasopressin V1b receptor
Protein ID: PT01648, Vasopressin V2 receptor