In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2011 | 24 | Yes |
Popular Name: N-[2-[4-[2-(diethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]butanamide N-[2-[4-[2-(diethylamino)-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) | 0.47 | 6.93 | -42.9 | 2 | 7 | 1 | 74 | 341.476 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.47 | 5.27 | -12.13 | 1 | 7 | 0 | 73 | 340.468 | 8 | ↓ |