In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2010 | 37 | No |
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) | 2.80 | 4.61 | -57.6 | 0 | 11 | -1 | 135 | 541.997 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 6.36 | -35.96 | 1 | 11 | 0 | 132 | 543.005 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.