| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 2011 | 26 | No |
Popular Name: 3-methyl-N-[(3-nitrophenyl)methyl]-4-oxo-2-sulfanyl-quinazoline-7-carboxamide 3-methyl-N-[(3-nitrophenyl)methy…
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| 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) | 2.00 | 6.74 | -45.39 | 1 | 8 | -1 | 116 | 369.382 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 7.99 | -18.41 | 2 | 8 | 0 | 113 | 370.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
