General Information of the Compound
| Compound ID |
CP0472843
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-hydroxy-4-[[14-methyl-5-(2-morpholin-4-ium-4-ylethoxy)-13,15-dioxo-9,12,14-triazatetracyclo[10.3.1.02,10.03,8]hexadeca-2(10),3(8),4,6-tetraen-9-yl]methyl]benzamide;chloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H32ClN5O6
|
||||||||||||||||||
| Molecular Weight |
570.046
|
||||||||||||||||||
| Canonical SMILES |
Cl.CN1C(=O)C2CN(Cc3c2c2cc(OCCN4CCOCC4)ccc2n3Cc2ccc(cc2)C(=O)NO)C1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H31N5O6.ClH/c1-30-27(35)22-16-32(28(30)36)17-24-25(22)21-14-20(39-13-10-31-8-11-38-12-9-31)6-7-23(21)33(24)15-18-2-4-19(5-3-18)26(34)29-37;/h2-7,14,22,37H,8-13,15-17H2,1H3,(H,29,34);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
ACFPHWYKTQAYSL-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