In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 25 | Yes |
Popular Name: 3,4-dichloro-N-[[1-[(1-methylpyrrol-2-yl)methyl]-4-piperidyl]methyl]benzamide 3,4-dichloro-N-[[1-[(1-methylpyr…
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) | 3.84 | 10.82 | -51.11 | 2 | 4 | 1 | 38 | 381.327 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.58 | -11.68 | 1 | 4 | 0 | 37 | 380.319 | 5 | ↓ |