In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2011 | 21 | Yes |
Popular Name: ethyl ethyl
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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) | 1.53 | 7.3 | -37.45 | 1 | 5 | 1 | 43 | 299.435 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 4.9 | -5.1 | 0 | 5 | 0 | 42 | 298.427 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | 9.31 | -117.09 | 2 | 5 | 2 | 44 | 300.443 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.