In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2010 | 34 | 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) | 1.37 | 4.4 | -13.76 | 1 | 9 | 0 | 109 | 486.594 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.37 | 4.86 | -43.19 | 2 | 9 | 1 | 110 | 487.602 | 5 | ↓ |