In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2008 | 31 | No |
Popular Name: 3-hydroxy-4-[(1-hydroxy-2-naphthyl)azo]-8-nitro-naphthalene-1-sulfonic 3-hydroxy-4-[(1-hydroxy-2-naphth…
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) | 2.74 | 3.17 | -61.22 | 2 | 10 | -1 | 168 | 438.397 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 7.15 | -95.19 | 1 | 10 | -2 | 168 | 437.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 3.93 | -121.97 | 1 | 10 | -2 | 171 | 437.389 | 4 | ↓ |