In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 20 | 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) | 3.04 | 8.92 | -12.36 | 0 | 3 | 0 | 35 | 264.328 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.04 | 9.38 | -45.17 | 1 | 3 | 1 | 36 | 265.336 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.