General Information of the Compound
| Compound ID |
CP0510382
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-Methyl-2-{(R)-2-(1-methyl-1H-indol-3-yl)-1-[(S)-4-methyl-2-(3-pyridin-2-yl-ureido)-pentanoylamino]-ethyl}-oxazole-4-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H32N6O5
|
||||||||||||||||||
| Molecular Weight |
532.601
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C[C@H](NC(=O)Nc1ccccn1)C(=O)N[C@H](Cc1cn(C)c2ccccc12)c1nc(C(O)=O)c(C)o1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H32N6O5/c1-16(2)13-20(31-28(38)32-23-11-7-8-12-29-23)25(35)30-21(26-33-24(27(36)37)17(3)39-26)14-18-15-34(4)22-10-6-5-9-19(18)22/h5-12,15-16,20-21H,13-14H2,1-4H3,(H,30,35)(H,36,37)(H2,29,31,32,38)/t20-,21+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
RHFGRSNVCQCNLO-LEWJYISDSA-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