General Information of the Compound
| Compound ID |
CP0902361
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Trans-2,5-Dichloro-N-[4-(3,3-dimethyl-2-oxo-2,3-dihydro-indol-1-ylmethyl)-cyclohexyl]-benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C24H26Cl2N2O2
|
||||||||||||||||||
| Molecular Weight |
445.39
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)C(=O)N(C[C@H]2CC[C@H](NC(=O)c3cc(Cl)ccc3Cl)CC2)c2ccccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H26Cl2N2O2/c1-24(2)19-5-3-4-6-21(19)28(23(24)30)14-15-7-10-17(11-8-15)27-22(29)18-13-16(25)9-12-20(18)26/h3-6,9,12-13,15,17H,7-8,10-11,14H2,1-2H3,(H,27,29)/t15-,17-
Show/Hide
|
||||||||||||||||||
| InChIKey |
LZJSMSFCBCGKLK-JCNLHEQBSA-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