In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 27 | Yes |
Popular Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-prop-2-ynyl-benzamide 4-(3,4-dihydro-2H-1,5-benzodioxe…
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) | 1.84 | 4.05 | -17.85 | 2 | 7 | 0 | 94 | 386.429 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 4.12 | -43.54 | 1 | 7 | -1 | 96 | 385.421 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.