In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 14 | 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) | -0.43 | 1.04 | -6.66 | 3 | 6 | 0 | 89 | 190.21 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.43 | 2.09 | -33.86 | 4 | 6 | 1 | 90 | 191.218 | 2 | ↓ |