In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: 1-(1-methylpyrazol-4-yl)-N-[[1-(1-piperidyl)cyclohexyl]methyl]methanamine 1-(1-methylpyrazol-4-yl)-N-[[1-(…
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) | 2.79 | 7.84 | -36.75 | 2 | 4 | 1 | 34 | 291.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 9.05 | -115.23 | 3 | 4 | 2 | 39 | 292.471 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 6.91 | -40.57 | 2 | 4 | 1 | 38 | 291.463 | 5 | ↓ |