In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2009 | 28 | Yes |
Popular Name: (3S)-1-acetyl-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]propyl]piperidine-3-carboxamide (3S)-1-acetyl-N-[3-[(2S)-4-methy…
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) | 1.36 | 8.07 | -45.48 | 2 | 6 | 1 | 57 | 387.548 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 9.94 | -125.81 | 3 | 6 | 2 | 58 | 388.556 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.68 | -11.78 | 1 | 6 | 0 | 56 | 386.54 | 6 | ↓ |