General Information of the Compound
| Compound ID |
CP0916790
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-6-Cyclopropylmethyl-7-ethyl-2-(4-methoxy-2-methyl-phenyl)-4-methyl-7,8-dihydro-6H-1,3,6,8a-tetraaza-acenaphthylene
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H28N4O
|
||||||||||||||||||
| Molecular Weight |
376.504
|
||||||||||||||||||
| Canonical SMILES |
CC[C@H]1Cn2nc(-c3ccc(OC)cc3C)c3nc(C)cc(c32)N1CC1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H28N4O/c1-5-17-13-27-23-20(26(17)12-16-6-7-16)11-15(3)24-22(23)21(25-27)19-9-8-18(28-4)10-14(19)2/h8-11,16-17H,5-7,12-13H2,1-4H3/t17-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XRUBMOVAKROZBV-KRWDZBQOSA-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