In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 27 | 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) | 1.79 | 6 | -61.03 | 0 | 7 | -1 | 92 | 366.349 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.79 | 5.25 | -15.61 | 1 | 7 | 0 | 89 | 367.357 | 5 | ↓ |