| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-2-[[4-[(1S)-1-methylpropyl]piperazin-1-yl]methyl]cyclopentanol (1S,2R)-2-[[4-[(1S)-1-methylprop…
| 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) | 2.08 | 4.07 | -30.61 | 2 | 3 | 1 | 28 | 241.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 4.35 | -33.68 | 2 | 3 | 1 | 28 | 241.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 2.18 | -2.5 | 1 | 3 | 0 | 27 | 240.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
