In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 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) | 3.62 | 10.87 | -26.45 | 2 | 8 | 0 | 96 | 475.574 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 11.64 | -86.29 | 3 | 8 | 0 | 98 | 476.582 | 6 | ↓ |