In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 1-[(3R)-3-(2-fluorophenyl)-4-methyl-piperazin-1-yl]pentan-1-one 1-[(3R)-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) | 3.20 | 7.74 | -9.15 | 0 | 3 | 0 | 24 | 278.371 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 9.25 | -48.41 | 1 | 3 | 1 | 25 | 279.379 | 4 | ↓ |