In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 31 | 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) | 3.59 | -1.68 | -20.33 | 0 | 6 | 0 | 60 | 436.943 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.59 | -1.42 | -44.38 | 1 | 6 | 1 | 62 | 437.951 | 4 | ↓ |