General Information of the Compound
| Compound ID |
CP0386121
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N',4-diethyl-N-(1H-indol-6-ylsulfonyl)-3,4-dihydropyrazole-2-carboximidamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H21N5O2S
|
||||||||||||||||||
| Molecular Weight |
347.444
|
||||||||||||||||||
| Canonical SMILES |
CCN\C(=N/S(=O)(=O)c1ccc2cc[nH]c2c1)N1CC(CC)C=N1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H21N5O2S/c1-3-12-10-19-21(11-12)16(17-4-2)20-24(22,23)14-6-5-13-7-8-18-15(13)9-14/h5-10,12,18H,3-4,11H2,1-2H3,(H,17,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DFPUPZMYPJSLGL-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