In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 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) | 3.42 | 6.46 | -9.25 | 1 | 3 | 0 | 38 | 227.292 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 6.9 | -41.64 | 2 | 3 | 1 | 39 | 228.3 | 2 | ↓ |