In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 34 | Yes |
Popular Name: (3S)-1-(4-benzylpiperazin-1-yl)-3-(4-fluorophenyl)-3-(1-methylindol-3-yl)propan-1-one (3S)-1-(4-benzylpiperazin-1-yl)-…
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) | 4.80 | 14.42 | -13.54 | 0 | 4 | 0 | 28 | 455.577 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 16.63 | -52.8 | 1 | 4 | 1 | 30 | 456.585 | 6 | ↓ |