In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2011 | 29 | Yes |
Popular Name: (3R)-N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide (3R)-N-[[2-(dimethylaminomethyl)…
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) | 2.10 | 11.18 | -40.9 | 2 | 5 | 1 | 54 | 398.502 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.10 | 8.49 | -10.13 | 1 | 5 | 0 | 53 | 397.494 | 6 | ↓ |