In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2008 | 16 | 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) | 1.86 | 6.14 | -32.66 | 2 | 3 | 1 | 39 | 214.292 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.86 | 6.42 | -77.01 | 3 | 3 | 2 | 40 | 215.3 | 4 | ↓ |