In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 20 | 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) | 1.90 | 5.31 | -8.95 | 3 | 4 | 0 | 68 | 287.388 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 5.78 | -40.04 | 4 | 4 | 1 | 69 | 288.396 | 5 | ↓ |