| 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]cyclopentanamine (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) | 1.58 | 4.93 | -89.1 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.05 | -42.47 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
