In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 7th, 2009 | 20 | Yes |
Popular Name: 7-chloro-2-[[(3S)-3-methyl-1-piperidyl]methyl]-3H-quinazolin-4-one 7-chloro-2-[[(3S)-3-methyl-1-pip…
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) | 2.70 | 6.22 | -6.96 | 1 | 4 | 0 | 49 | 291.782 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 8.4 | -47.76 | 2 | 4 | 1 | 50 | 292.79 | 2 | ↓ |