In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 34 | 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) | 3.21 | 9.99 | -21.11 | 0 | 7 | 0 | 89 | 516.044 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 10.45 | -55.45 | 1 | 7 | 1 | 91 | 517.052 | 8 | ↓ |