General Information of the Compound
| Compound ID |
CP0372078
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-2-Phenyl-5-trifluoromethyloxazole-4-carboxylic Acid-[2-(3-Hydroxypyrrolidin-1-yl)pyrimidin-5-yl]amide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H16F3N5O3
|
||||||||||||||||||
| Molecular Weight |
419.363
|
||||||||||||||||||
| Canonical SMILES |
O[C@H]1CCN(C1)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H16F3N5O3/c20-19(21,22)15-14(26-17(30-15)11-4-2-1-3-5-11)16(29)25-12-8-23-18(24-9-12)27-7-6-13(28)10-27/h1-5,8-9,13,28H,6-7,10H2,(H,25,29)/t13-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
JOAQPUGHMNETNS-ZDUSSCGKSA-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