In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2008 | 18 | Yes |
Popular Name: 2-[[[(1S)-1,2-dimethylpropyl]amino]methyl]-3H-quinazolin-4-one 2-[[[(1S)-1,2-dimethylpropyl]ami…
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) | 2.10 | 4.65 | -8.35 | 2 | 4 | 0 | 58 | 245.326 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 3.13 | -42.95 | 2 | 4 | 0 | 65 | 245.326 | 4 | ↓ |