In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | No |
Popular Name: 2-(1,4-diazepan-1-yl)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-2-oxo-acetamide 2-(1,4-diazepan-1-yl)-N-[(3R)-1,…
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) | -1.90 | 0.68 | -57.8 | 2 | 7 | 1 | 91 | 304.392 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.90 | -0.44 | -14.3 | 1 | 7 | 0 | 87 | 303.384 | 2 | ↓ |