In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 30 | 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) | 4.01 | 6.98 | -44.43 | 0 | 7 | -1 | 93 | 472.315 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 9.64 | -11.11 | 1 | 7 | 0 | 90 | 473.323 | 6 | ↓ |