In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 32 | 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) | 3.99 | 8.89 | -190.21 | 0 | 10 | -3 | 163 | 448.392 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.99 | 9.3 | -118.17 | 1 | 10 | -2 | 161 | 449.4 | 4 | ↓ |