In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 36 | 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) | 2.85 | 11.29 | -55 | 0 | 9 | -1 | 105 | 490.536 | 11 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 9.97 | -20.35 | 1 | 9 | 0 | 103 | 491.544 | 11 | ↓ |