In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 20 | Yes |
Popular Name: N-[(1S,2S)-2-methylcyclohexyl]-4-oxo-4-piperazin-1-yl-butanamide N-[(1S,2S)-2-methylcyclohexyl]-4…
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) | 0.75 | 4.76 | -50.7 | 3 | 5 | 1 | 66 | 282.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.75 | 3.39 | -9.73 | 2 | 5 | 0 | 61 | 281.4 | 4 | ↓ |