In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2009 | 25 | Yes |
Popular Name: N-(2-furylmethyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,4-diazepan-1-yl]acetamide N-(2-furylmethyl)-2-[4-(2-oxo-2-…
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) | 0.52 | 5 | -43.63 | 2 | 7 | 1 | 70 | 349.455 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 4.98 | -45.02 | 2 | 7 | 1 | 70 | 349.455 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 2.96 | -16.4 | 1 | 7 | 0 | 69 | 348.447 | 6 | ↓ |