General Information of the Compound
| Compound ID |
CP0427923
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(1-(4-chlorophenoxy)-9-(piperidin-4-ylmethyl)-9H-carbazol-3-yl)(4-methylpiperazin-1-yl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H33ClN4O2
|
||||||||||||||||||
| Molecular Weight |
517.073
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CC3CCNCC3)c3ccccc3c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H33ClN4O2/c1-33-14-16-34(17-15-33)30(36)22-18-26-25-4-2-3-5-27(25)35(20-21-10-12-32-13-11-21)29(26)28(19-22)37-24-8-6-23(31)7-9-24/h2-9,18-19,21,32H,10-17,20H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
SJYNPVUODRUKRP-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