In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 23 | Yes |
Popular Name: 3-bromo-N-[2-[(5-isobutyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]benzamide 3-bromo-N-[2-[(5-isobutyl-1,3,4-…
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) | 2.84 | 5.87 | -17.36 | 2 | 6 | 0 | 84 | 397.298 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 4.81 | -42.94 | 1 | 6 | -1 | 90 | 396.29 | 6 | ↓ |