In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 33 | 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) | 3.83 | 6.78 | -15.41 | 1 | 9 | 0 | 104 | 458.511 | 14 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 6.01 | -49.88 | 0 | 9 | -1 | 106 | 457.503 | 14 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 7.48 | -38.94 | 2 | 9 | 1 | 105 | 459.519 | 14 | ↓ |
No pre-computed analogs available. Try a structural similarity search.