| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 21 | No |
Popular Name: 3-[(1R)-1-methyl-2-morpholino-ethyl]-2-sulfanyl-quinazolin-4-one 3-[(1R)-1-methyl-2-morpholino-et…
| 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) | 2.01 | 5.02 | -37.76 | 0 | 5 | -1 | 47 | 304.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.44 | -28.62 | 1 | 5 | 0 | 49 | 305.403 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 5.31 | -9.55 | 1 | 5 | 0 | 50 | 305.403 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 7.74 | -31.87 | 2 | 5 | 1 | 51 | 306.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
