In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2011 | 23 | Yes |
Popular Name: 3-[[[(1S)-1-isoxazol-3-ylethyl]-methyl-amino]methyl]-7-methylsulfanyl-1H-quinolin-2-one 3-[[[(1S)-1-isoxazol-3-ylethyl]-…
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) | 1.98 | 7.68 | -40.05 | 2 | 5 | 1 | 63 | 330.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 5.41 | -15.12 | 1 | 5 | 0 | 62 | 329.425 | 5 | ↓ |