In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 26 | 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) | 1.97 | 6.06 | -75.08 | 1 | 7 | -1 | 107 | 375.426 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 4.3 | -23.86 | 2 | 7 | 0 | 104 | 376.434 | 4 | ↓ |