In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(4-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]propan-1-amine (1S)-1-(4-fluorophenyl)-N-[2-(4-…
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) | 1.74 | 7.4 | -95.44 | 3 | 3 | 2 | 24 | 281.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 5.03 | -44.17 | 2 | 3 | 1 | 23 | 280.411 | 6 | ↓ |