In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2009 | 38 | 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) | 5.26 | 12.32 | -57.62 | 0 | 8 | -1 | 97 | 524.634 | 16 | ↓ |
Lo Low (pH 4.5-6) | 5.26 | 11.02 | -20.34 | 1 | 8 | 0 | 95 | 525.642 | 16 | ↓ |