In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 13 | Yes |
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) | -1.79 | -1.2 | -53.99 | 3 | 6 | -1 | 112 | 187.175 | 6 | ↓ |
Lo Low (pH 4.5-6) | -1.79 | -3.17 | -17.26 | 4 | 6 | 0 | 109 | 188.183 | 6 | ↓ |