In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 19 | Yes |
Popular Name: butyl butyl
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) | 2.91 | 6.81 | -7.39 | 0 | 4 | 0 | 39 | 263.337 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 8.82 | -39.03 | 1 | 4 | 1 | 40 | 264.345 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.