General Information of the Compound
| Compound ID |
CP0503582
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(3-Chloro-phenyl)-2-[1-methyl-2-(4-methyl-1H-indol-3-yl)-ethylamino]-ethanol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H23ClN2O
|
||||||||||||||||||
| Molecular Weight |
342.87
|
||||||||||||||||||
| Canonical SMILES |
CC(Cc1c[nH]c2cccc(C)c12)NCC(O)c1cccc(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H23ClN2O/c1-13-5-3-8-18-20(13)16(11-23-18)9-14(2)22-12-19(24)15-6-4-7-17(21)10-15/h3-8,10-11,14,19,22-24H,9,12H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZBBKSSFBAYHGKM-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