In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 26 | 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) | 0.71 | 5.76 | -13.84 | 1 | 7 | 0 | 80 | 353.426 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.71 | 6.16 | -40.03 | 2 | 7 | 1 | 81 | 354.434 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.