General Information of the Compound
| Compound ID |
CP0664321
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Heptanedioic acid hydroxyamide (10-hydroxy-14-methyl-5-oxo-5,7,8,13,13b,14-hexahydro-indolo[2',3':3,4]pyrido[2,1-b]quinazolin-3-yl)-amide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H29N5O5
|
||||||||||||||||||
| Molecular Weight |
491.548
|
||||||||||||||||||
| Canonical SMILES |
CN1c2ccc(NC(=O)CCCCCC(=O)NO)cc2C(=O)N2CCc3c([nH]c4ccc(O)cc34)C21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H29N5O5/c1-30-21-10-7-15(27-22(33)5-3-2-4-6-23(34)29-36)13-19(21)26(35)31-12-11-17-18-14-16(32)8-9-20(18)28-24(17)25(30)31/h7-10,13-14,25,28,32,36H,2-6,11-12H2,1H3,(H,27,33)(H,29,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UMBUYUXNROMJRJ-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