| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2009 | 24 | No |
Popular Name: 3-methyl-4-oxo-N-[(1S)-1-(3-pyridyl)ethyl]-2-sulfanyl-quinazoline-7-carboxamide 3-methyl-4-oxo-N-[(1S)-1-(3-pyri…
| 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) | 1.39 | 6.18 | -44.87 | 1 | 6 | -1 | 83 | 339.4 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 6.6 | -17 | 2 | 6 | 0 | 80 | 340.408 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 7.04 | -59.62 | 3 | 6 | 1 | 81 | 341.416 | 3 | ↓ |
