General Information of the Compound
| Compound ID |
CP0904440
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-Pyridin-4-yl-N'7-pyridin-2-yl-N'4-(R)-pyrrolidin-3-yl-thieno[3,2-d]pyrimidine-4,7-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H19N7S
|
||||||||||||||||||
| Molecular Weight |
389.488
|
||||||||||||||||||
| Canonical SMILES |
c1ccc(Nc2csc3c(N[C@@H]4CCNC4)nc(-c4ccncc4)nc23)nc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H19N7S/c1-2-7-23-16(3-1)25-15-12-28-18-17(15)26-19(13-4-8-21-9-5-13)27-20(18)24-14-6-10-22-11-14/h1-5,7-9,12,14,22H,6,10-11H2,(H,23,25)(H,24,26,27)/t14-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SCELUELGRZTJDT-CQSZACIVSA-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