In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 23 | 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) | 1.10 | 4.41 | -59.37 | 5 | 6 | 1 | 90 | 314.413 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 4.56 | -110.19 | 6 | 6 | 2 | 91 | 315.421 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.