| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2011 | 20 | Yes |
Popular Name: (3R)-4-(3-chloro-4-hydroxy-benzoyl)-3-isopropyl-piperazin-2-one (3R)-4-(3-chloro-4-hydroxy-benzo…
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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) | 1.37 | 1.68 | -12.59 | 2 | 5 | 0 | 70 | 296.754 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 2.45 | -39.79 | 1 | 5 | -1 | 72 | 295.746 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
