In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | No |
Popular Name: (E)-4-[4-(methanesulfonamido)-3-methyl-anilino]-4-oxo-but-2-enoic (E)-4-[4-(methanesulfonamido)-3-…
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) | 0.49 | 2.21 | -50.37 | 2 | 7 | -1 | 115 | 297.312 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.49 | 2.27 | -91.64 | 1 | 7 | -2 | 117 | 296.304 | 5 | ↓ |