Compound 0EC
Identifiers
- Canonical SMILES:
COc1cc2nc(nc(N)c2cc1OC)N3CCNCC3
- IUPAC name:
6,7-dimethoxy-2-(piperazin-1-yl)quinazolin-4-amine
- InChi:
InChI=1S/C14H19N5O2/c1-20-11-7-9-10(8-12(11)21-2)17-14(18-13(9)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
- InChiKey:
APKHJGDGWQDBGM-UHFFFAOYSA-N
Chemistry rules
Lipinski's RO5 | Veber | Pfizer's 3/75 |
---|---|---|
External links
RNA-SM complexes
Physicochemical filters
Descriptor | Lipinski's RO5 | Veber | Pfizer's 3/75 | |
---|---|---|---|---|
Compliance | ||||
MW | 289.15 g/mol | |||
HBA | 7 | |||
HBD | 2 | |||
HBA + HBD | ||||
AlogP | 0.64 | |||
TPSA | 85.53 | |||
RB | 3 |