| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 17 | No |
Popular Name: 1,3-dimethyl-5-(4-methyl-1,4-diazepan-1-yl)pyrazole-4-carbaldehyde 1,3-dimethyl-5-(4-methyl-1,4-dia…
| 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) | 0.71 | 6.53 | -49.23 | 1 | 5 | 1 | 43 | 237.327 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.71 | 4.52 | -6.82 | 0 | 5 | 0 | 41 | 236.319 | 2 | ↓ |
