In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 1st, 2009 | 28 | Yes |
Popular Name: 1-[3-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]phenyl]pyrrolidin-2-one 1-[3-[4-[(2-fluorophenyl)methyl]…
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) | 1.65 | 8.79 | -21.04 | 0 | 5 | 0 | 44 | 381.451 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 10.99 | -51.31 | 1 | 5 | 1 | 45 | 382.459 | 4 | ↓ |