In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 25 | No |
Popular Name: (Z)-4-[(3-hydroxy-9,10-dioxo-2-anthryl)amino]-4-oxo-but-2-enoic (Z)-4-[(3-hydroxy-9,10-dioxo-2-a…
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) | 2.30 | 5.53 | -70.96 | 2 | 7 | -1 | 124 | 336.279 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.30 | 6.3 | -121.19 | 1 | 7 | -2 | 126 | 335.271 | 3 | ↓ |