General Information of the Compound
| Compound ID |
CP0567491
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[5-(2-phenylethylamino)-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-2-yl]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H33N5O2
|
||||||||||||||||||
| Molecular Weight |
471.605
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1ccc(cc1)-n1nc2CCC(Cc2c1C(=O)N1CCCCC1)NCCc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H33N5O2/c29-27(34)21-9-12-23(13-10-21)33-26(28(35)32-17-5-2-6-18-32)24-19-22(11-14-25(24)31-33)30-16-15-20-7-3-1-4-8-20/h1,3-4,7-10,12-13,22,30H,2,5-6,11,14-19H2,(H2,29,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OAPFEDKKCBUWMF-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