In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (2R)-2-methyl-3-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]propanenitrile (2R)-2-methyl-3-[(2S)-4-methyl-2…
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) | 2.35 | 8.16 | -45.51 | 1 | 3 | 1 | 31 | 244.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 5.8 | -5.8 | 0 | 3 | 0 | 30 | 243.354 | 3 | ↓ |