| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 24 | No |
Popular Name: (2S)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-isobutylsulfanyl-propanamide (2S)-N-(1,5-dimethyl-3-oxo-2-phe…
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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) | 2.52 | 8.97 | -28.63 | 1 | 5 | 0 | 56 | 347.484 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 8.17 | -70.17 | 0 | 5 | -1 | 62 | 346.476 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
