In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 24 | Yes |
Popular Name: 1-[(3S)-3-(2-fluorophenyl)-4-methyl-piperazin-1-yl]-3-phenyl-propan-1-one 1-[(3S)-3-(2-fluorophenyl)-4-met…
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) | 3.58 | 9.64 | -11.1 | 0 | 3 | 0 | 24 | 326.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 11.57 | -47.64 | 1 | 3 | 1 | 25 | 327.423 | 4 | ↓ |