| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | Yes |
Popular Name: [4-[(2R)-2-hydroxy-3,3-dimethyl-butyl]piperazin-1-yl]-(2-methyl-3-furyl)methanone [4-[(2R)-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) | 1.02 | 3.06 | -8.42 | 1 | 5 | 0 | 57 | 294.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.02 | 5.27 | -44.11 | 2 | 5 | 1 | 58 | 295.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
