In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 18 | 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) | 1.07 | 2.7 | -15.78 | 6 | 6 | 0 | 102 | 240.27 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 3.13 | -26.54 | 7 | 6 | 1 | 103 | 241.278 | 2 | ↓ |