| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 19 | Yes |
Popular Name: N-[[1,3-dimethyl-5-(4-methyl-1,4-diazepan-1-yl)pyrazol-4-yl]methyl]ethanamine N-[[1,3-dimethyl-5-(4-methyl-1,4…
| 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) | 0.86 | 7.57 | -104.56 | 3 | 5 | 2 | 42 | 267.421 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 6.41 | -38.97 | 2 | 5 | 1 | 38 | 266.413 | 4 | ↓ |
