| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 23 | No |
Popular Name: 3-ethyl-7-[(3R)-3-hydroxypiperidine-1-carbonyl]-2-sulfanyl-quinazolin-4-one 3-ethyl-7-[(3R)-3-hydroxypiperid…
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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) | 0.57 | 3.51 | -36.32 | 1 | 6 | -1 | 81 | 332.405 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 4.78 | -12.99 | 2 | 6 | 0 | 78 | 333.413 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
