In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 29 | 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) | 0.83 | 3.94 | -61.91 | 1 | 10 | -1 | 149 | 401.351 | 9 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 3.12 | -20.86 | 2 | 10 | 0 | 146 | 402.359 | 9 | ↓ |