In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 28 | 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) | 2.07 | 7.11 | -61.81 | 0 | 7 | -1 | 92 | 382.392 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 6.36 | -14.68 | 1 | 7 | 0 | 89 | 383.4 | 6 | ↓ |