In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 38 | 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) | 2.65 | 10.79 | -23.44 | 1 | 8 | 0 | 86 | 515.589 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 11.14 | -50.69 | 2 | 8 | 1 | 87 | 516.597 | 7 | ↓ |