In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 33 | No |
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) | 0.67 | 5.68 | -25.91 | 1 | 11 | 0 | 154 | 488.503 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.67 | 5.59 | -123.17 | 3 | 11 | 2 | 157 | 490.519 | 7 | ↓ |