In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 14 | Yes |
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) | 1.24 | 3.67 | -7.88 | 3 | 4 | 0 | 68 | 188.234 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 4.13 | -27.29 | 4 | 4 | 1 | 69 | 189.242 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 4.13 | -29.68 | 4 | 4 | 1 | 69 | 189.242 | 2 | ↓ |