| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2011 | 25 | No |
Popular Name: 4-methyl-1-[[1-[(1R)-1-(3-nitrophenyl)ethyl]-4-piperidyl]methyl]piperidine 4-methyl-1-[[1-[(1R)-1-(3-nitrop…
| 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) | 4.19 | 14.06 | -112.62 | 2 | 5 | 2 | 55 | 347.503 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.19 | 12.01 | -41.11 | 1 | 5 | 1 | 53 | 346.495 | 5 | ↓ |
