In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 17 | Yes |
Popular Name: YA-6468 YA-6468
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) | 2.75 | 7.6 | -50.03 | 0 | 3 | -1 | 53 | 230.218 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 8.04 | -47.14 | 1 | 3 | 0 | 54 | 231.226 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.