In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: 1-[[(1R)-1-cyclohex-3-enyl]methyl]-4-(1-ethylpropyl)piperazine 1-[[(1R)-1-cyclohex-3-enyl]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) | 3.78 | 8.91 | -34.92 | 1 | 2 | 1 | 8 | 251.438 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 8.66 | -30.11 | 1 | 2 | 1 | 8 | 251.438 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 6.94 | -0.42 | 0 | 2 | 0 | 6 | 250.43 | 5 | ↓ |