| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | Yes |
Popular Name: [4-[(2S)-2-hydroxy-3,3-dimethyl-butyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone [4-[(2S)-2-hydroxy-3,3-dimethyl-…
| 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) | 0.23 | 1.85 | -10.52 | 1 | 6 | 0 | 62 | 294.399 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.23 | 4.13 | -46.48 | 2 | 6 | 1 | 63 | 295.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
