General Information of the Compound
| Compound ID |
CP0531409
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(7-cyano-9H-pyrido[3,4-b]indol-3-yl)cyclopropanecarboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C16H12N4O
|
||||||||||||||||||
| Molecular Weight |
276.299
|
||||||||||||||||||
| Canonical SMILES |
O=C(Nc1cc2c(cn1)[nH]c1cc(ccc21)C#N)C1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H12N4O/c17-7-9-1-4-11-12-6-15(20-16(21)10-2-3-10)18-8-14(12)19-13(11)5-9/h1,4-6,8,10,19H,2-3H2,(H,18,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PJDYXSIVOJSYDM-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 | |||||||||||||||||||
| 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