In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 35 | 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) | 4.99 | 10.28 | -69.32 | 1 | 7 | -1 | 103 | 485.541 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.99 | 8.98 | -28.36 | 2 | 7 | 0 | 100 | 486.549 | 5 | ↓ |