In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 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) | -2.56 | 8.27 | -33.06 | 3 | 8 | 1 | 106 | 375.412 | 3 | ↓ |
Lo Low (pH 4.5-6) | -2.56 | 8.71 | -86.41 | 4 | 8 | 2 | 108 | 376.42 | 3 | ↓ |