In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 34 | No |
Popular Name: 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide 3-[[(E)-3-(3-nitrophenyl)prop-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) | 4.90 | 11.82 | -34.85 | 2 | 9 | 0 | 130 | 471.498 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 9.47 | -76.67 | 1 | 9 | -1 | 136 | 470.49 | 7 | ↓ |