General Information of the Compound
| Compound ID |
CP0421492
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[(2,5-diethylpyrazole-3-carbonyl)amino]-7-methoxy-1-propylbenzimidazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H26N6O3
|
||||||||||||||||||
| Molecular Weight |
398.467
|
||||||||||||||||||
| Canonical SMILES |
CCCn1c(NC(=O)c2cc(CC)nn2CC)nc2cc(cc(OC)c12)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H26N6O3/c1-5-8-25-17-14(9-12(18(21)27)10-16(17)29-4)22-20(25)23-19(28)15-11-13(6-2)24-26(15)7-3/h9-11H,5-8H2,1-4H3,(H2,21,27)(H,22,23,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MRJRTCABKNRZQA-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