In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 21 | Yes |
Popular Name: 1-[(1R,3R)-3-methylcyclohexyl]-4-(o-tolylmethyl)piperazine 1-[(1R,3R)-3-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) | 3.95 | 10.31 | -35.22 | 1 | 2 | 1 | 8 | 287.471 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.95 | 8.05 | -1.54 | 0 | 2 | 0 | 6 | 286.463 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 9.97 | -33.96 | 1 | 2 | 1 | 8 | 287.471 | 3 | ↓ |