In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 34 | 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) | 4.24 | 9.31 | -13.55 | 1 | 6 | 0 | 64 | 485.625 | 13 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 11.33 | -57.47 | 2 | 6 | 1 | 65 | 486.633 | 13 | ↓ |