In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2010 | 21 | Yes |
Popular Name: (2R)-4-methyl-2-phenyl-1-[2-[(3S)-3-piperidyl]ethyl]piperazine (2R)-4-methyl-2-phenyl-1-[2-[(3S…
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) | 2.29 | 8.31 | -83.8 | 3 | 3 | 2 | 24 | 289.467 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 5.94 | -38.48 | 2 | 3 | 1 | 23 | 288.459 | 4 | ↓ |