In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: (1S)-1-[5-fluoro-2-(4-isopropylpiperazin-1-yl)phenyl]ethanamine (1S)-1-[5-fluoro-2-(4-isopropylp…
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) | 0.56 | 7.18 | -97.49 | 4 | 3 | 2 | 35 | 267.392 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 5.04 | -44.56 | 3 | 3 | 1 | 34 | 266.384 | 3 | ↓ |