In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 34 | 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) | 3.90 | 9.26 | -54.77 | 0 | 10 | -1 | 143 | 460.422 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.44 | 11.03 | -17.43 | 1 | 10 | 0 | 140 | 461.43 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.