In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 28 | 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) | 3.46 | 9.32 | -12.58 | 0 | 5 | 0 | 52 | 378.472 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 9.98 | -36.3 | 1 | 5 | 1 | 53 | 379.48 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.