In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 20 | No |
Popular Name: 2-[[2-(1,4-diazepan-1-yl)-2-oxo-ethyl]-propyl-amino]-N,N-dimethyl-acetamide 2-[[2-(1,4-diazepan-1-yl)-2-oxo-…
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) | -0.95 | 5.76 | -104.02 | 3 | 6 | 2 | 62 | 286.42 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.95 | 3.81 | -46.59 | 2 | 6 | 1 | 60 | 285.412 | 6 | ↓ |