In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 20 | Yes |
Popular Name: 2-[[[(1S,2S)-2-methylcyclohexyl]amino]methyl]-3H-quinazolin-4-one 2-[[[(1S,2S)-2-methylcyclohexyl]…
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) | 2.80 | 5.81 | -8.33 | 2 | 4 | 0 | 58 | 271.364 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.25 | 4.43 | -42.45 | 2 | 4 | 0 | 65 | 271.364 | 3 | ↓ |