In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 32 | 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) | 1.35 | 3.6 | -72.76 | 3 | 8 | -1 | 133 | 441.435 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 2.84 | -26.19 | 4 | 8 | 0 | 130 | 442.443 | 9 | ↓ |