| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2011 | 20 | Yes |
Popular Name: 1-(4-methyl-1,4-diazepan-1-yl)-4-morpholino-butane-1,4-dione 1-(4-methyl-1,4-diazepan-1-yl)-4…
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| 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) | -0.44 | 5.47 | -42.21 | 1 | 6 | 1 | 54 | 284.38 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | 3.39 | -8.82 | 0 | 6 | 0 | 53 | 283.372 | 3 | ↓ |
