| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 24 | No |
Popular Name: N-methyl-N-[(1S)-1-(5-methyl-2-thienyl)ethyl]-4-oxo-2-sulfanyl-3H-quinazoline-7-carboxamide N-methyl-N-[(1S)-1-(5-methyl-2-t…
None
| 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) | 2.45 | 6.4 | -35.65 | 1 | 5 | -1 | 72 | 358.468 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 7.75 | -13.18 | 2 | 5 | 0 | 69 | 359.476 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
