In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 30 | 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) | 1.92 | 5.83 | -100.63 | 0 | 9 | -2 | 134 | 473.235 | 6 | ↓ |
Ref Reference (pH 7) | 1.92 | 5.72 | -99.56 | 0 | 9 | -2 | 134 | 473.235 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.46 | 8.37 | -58.67 | 1 | 9 | -1 | 131 | 474.243 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.