In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2008 | 26 | Yes |
Popular Name: (2R)-2-dimethylamino-2-(4-fluorophenyl)-1-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]ethanone (2R)-2-dimethylamino-2-(4-fluoro…
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) | 2.91 | 9.36 | -50.66 | 1 | 4 | 1 | 28 | 356.465 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 7.18 | -7.68 | 0 | 4 | 0 | 27 | 355.457 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 11.75 | -104.72 | 2 | 4 | 2 | 29 | 357.473 | 4 | ↓ |