In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 26 | Yes |
Popular Name: N-(1,3-benzodioxol-5-yl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide N-(1,3-benzodioxol-5-yl)-2,4-dio…
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) | 1.01 | -0.13 | -19.27 | 3 | 9 | 0 | 123 | 375.362 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.01 | -0.06 | -39.58 | 2 | 9 | -1 | 125 | 374.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.