In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 30 | Yes |
Popular Name: 2-[(1R)-1-[4-[(2R)-2-ethylhexanoyl]piperazin-1-yl]propyl]-3-methyl-quinazolin-4-one 2-[(1R)-1-[4-[(2R)-2-ethylhexano…
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.43 | 10.14 | -16.07 | 0 | 6 | 0 | 58 | 412.578 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 12.51 | -51.85 | 1 | 6 | 1 | 60 | 413.586 | 8 | ↓ |