In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 18 | Yes |
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) | 0.73 | 5.85 | -13.33 | 1 | 5 | 0 | 64 | 237.266 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.73 | 6.31 | -49.16 | 2 | 5 | 1 | 65 | 238.274 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.