General Information of the Compound
| Compound ID |
CP0399974
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(1-cyclohexyl-6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H20N2O3
|
||||||||||||||||||
| Molecular Weight |
324.38
|
||||||||||||||||||
| Canonical SMILES |
Oc1ccc(-c2nn(C3CCCCC3)c3cc(O)ccc23)c(O)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H20N2O3/c22-13-6-8-15-17(10-13)21(12-4-2-1-3-5-12)20-19(15)16-9-7-14(23)11-18(16)24/h6-12,22-24H,1-5H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
QMJSDDUXUCNLMV-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