In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2010 | 21 | Yes |
Popular Name: 7-chloro-2-[[(2R)-2-(hydroxymethyl)-1-piperidyl]methyl]-3H-quinazolin-4-one 7-chloro-2-[[(2R)-2-(hydroxymeth…
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) | 1.81 | 2.97 | -9.57 | 2 | 5 | 0 | 69 | 307.781 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 5.11 | -43.45 | 3 | 5 | 1 | 70 | 308.789 | 3 | ↓ |