In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 34 | No |
Popular Name: 4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide 4-[[(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) | 4.29 | 7.41 | -30.45 | 2 | 10 | 0 | 143 | 455.43 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.35 | 4.82 | -68.12 | 1 | 10 | -1 | 149 | 454.422 | 7 | ↓ |