| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2011 | 23 | No |
Popular Name: N-(cyanomethyl)-3-ethyl-4-oxo-N-propyl-2-sulfanyl-quinazoline-7-carboxamide N-(cyanomethyl)-3-ethyl-4-oxo-N-…
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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) | 1.48 | 7.07 | -40.54 | 0 | 6 | -1 | 85 | 329.405 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 8.35 | -15.24 | 1 | 6 | 0 | 82 | 330.413 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
