| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2011 | 23 | Yes |
Popular Name: (3S)-3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-1-methyl-piperidin-3-ol (3S)-3-[[4-(2,3-dimethylphenyl)p…
| 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) | 2.59 | 8.19 | -32.16 | 2 | 4 | 1 | 31 | 318.485 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 8.12 | -79.58 | 3 | 4 | 2 | 32 | 319.493 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
