General Information of the Compound
| Compound ID |
CP0465590
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[1-[(3-chlorophenyl)methyl]pyrrolidin-3-yl]-1H-indazol-5-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H19ClN4
|
||||||||||||||||||
| Molecular Weight |
326.831
|
||||||||||||||||||
| Canonical SMILES |
Clc1cccc(CN2CCC(C2)Nc2ccc3[nH]ncc3c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H19ClN4/c19-15-3-1-2-13(8-15)11-23-7-6-17(12-23)21-16-4-5-18-14(9-16)10-20-22-18/h1-5,8-10,17,21H,6-7,11-12H2,(H,20,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DBLHWYWZXQGUJM-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