In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2009 | 36 | Yes |
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) | 5.91 | 14.32 | -24.34 | 1 | 6 | 0 | 75 | 516.589 | 11 | ↓ |
Hi High (pH 8-9.5) | 6.10 | 13.24 | -49.72 | 0 | 6 | -1 | 82 | 515.581 | 11 | ↓ |