General Information of the Compound
| Compound ID |
CP0874675
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-N-((3-cyclopentyl-2-((N-hydroxyformamido)methyl)propanamido)methyl)-3-phenoxybenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H29N3O5
|
||||||||||||||||||
| Molecular Weight |
439.512
|
||||||||||||||||||
| Canonical SMILES |
O=CN(O)C[C@@H](CC1CCCC1)C(=O)NCNC(=O)c1cccc(Oc2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H29N3O5/c28-17-27(31)15-20(13-18-7-4-5-8-18)24(30)26-16-25-23(29)19-9-6-12-22(14-19)32-21-10-2-1-3-11-21/h1-3,6,9-12,14,17-18,20,31H,4-5,7-8,13,15-16H2,(H,25,29)(H,26,30)/t20-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
HGPDESJTWBFLBN-HXUWFJFHSA-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
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2