In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2011 | 16 | Yes |
Popular Name: YA-5764 YA-5764
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) | 0.44 | 2.07 | -52.66 | 2 | 6 | -1 | 106 | 237.216 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.90 | 0.12 | -90.94 | 1 | 6 | -2 | 109 | 236.208 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.