In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 35 | Yes |
None
None
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) | 4.89 | 10.81 | -19.01 | 1 | 8 | 0 | 90 | 485.514 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.89 | 12.97 | -62.43 | 2 | 8 | 1 | 91 | 486.522 | 6 | ↓ |