In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 30 | Yes |
Popular Name: (3R)-N-[(4-bromophenyl)methyl]-1-[2-(3-fluorophenyl)pyrimidin-4-yl]piperidine-3-carboxamide (3R)-N-[(4-bromophenyl)methyl]-1…
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) | 4.58 | 12.12 | -10.47 | 1 | 5 | 0 | 58 | 469.358 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | 12.47 | -34.41 | 2 | 5 | 1 | 59 | 470.366 | 5 | ↓ |