General Information of the Compound
| Compound ID |
CP0878648
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-((1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoyl)-4-methyl-N'-(1H-pyrazol-5-yl)benzenesulfonimidamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H25N5O2S
|
||||||||||||||||||
| Molecular Weight |
435.553
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(S(=O)(=Nc2ccn[nH]2)NC(=O)Nc2c3c(cc4c2CCC4)CCC3)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H25N5O2S/c1-15-8-10-18(11-9-15)31(30,27-21-12-13-24-26-21)28-23(29)25-22-19-6-2-4-16(19)14-17-5-3-7-20(17)22/h8-14H,2-7H2,1H3,(H3,24,25,26,27,28,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UPAMDEBUDRQYHM-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