In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 30 | No |
Popular Name: 1,3,5,7-tetrahydroxy-9,10-dioxo-4,8-bis-sulfanyl-anthracene-2,6-disulfonic 1,3,5,7-tetrahydroxy-9,10-dioxo-…
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) | -3.25 | -5.32 | -250.91 | 4 | 12 | -4 | 229 | 492.442 | 2 | ↓ |
Hi High (pH 8-9.5) | -3.25 | -4.32 | -395.49 | 3 | 12 | -5 | 232 | 491.434 | 2 | ↓ |
Lo Low (pH 4.5-6) | -3.25 | -5.86 | -159.89 | 4 | 12 | -3 | 229 | 493.45 | 2 | ↓ |
Lo Low (pH 4.5-6) | -3.25 | -6.4 | -84.25 | 4 | 12 | -2 | 229 | 494.458 | 2 | ↓ |