In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 21 | 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 | 6.51 | -12.89 | 0 | 4 | 0 | 38 | 321.471 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 8.61 | -64.84 | 1 | 4 | 1 | 39 | 322.479 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.