In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 18 | Yes |
Popular Name: 7-chloro-2-[[[(1R,2R)-2-methylcyclopropyl]amino]methyl]-3H-quinazolin-4-one 7-chloro-2-[[[(1R,2R)-2-methylcy…
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) | 2.28 | 4.55 | -7.47 | 2 | 4 | 0 | 58 | 263.728 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.28 | 5.37 | -52.79 | 3 | 4 | 1 | 62 | 264.736 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 3.27 | -39.62 | 2 | 4 | 0 | 65 | 263.728 | 3 | ↓ |