General Information of the Compound
| Compound ID |
CP0010399
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-[(1S)-1-cyclopropylethyl]-7-methyl-3H-isoindol-1-one
Show/Hide
|
||||||||||||||||||
| Formula |
C20H21N5O
|
||||||||||||||||||
| Molecular Weight |
347.422
|
||||||||||||||||||
| Canonical SMILES |
C[C@@H](C1CC1)N1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)nc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H21N5O/c1-11-7-15(14-5-6-25-17(9-14)22-20(21)23-25)8-16-10-24(19(26)18(11)16)12(2)13-3-4-13/h5-9,12-13H,3-4,10H2,1-2H3,(H2,21,23)/t12-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
IBRQJCOMQXDQQV-LBPRGKRZSA-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 | |||||||||||||||||||
| 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
Protein ID: PT01029, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform