In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 16 | 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) | 1.70 | 5.77 | -11.39 | 2 | 4 | 0 | 65 | 234.28 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 5.98 | -35.05 | 3 | 4 | 1 | 66 | 235.288 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.