| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 17 | Yes |
Popular Name: 6-[(2-ethoxy-1-methyl-2-oxoethyl)sulfanyl]nicotinic acid 6-[(2-ethoxy-1-methyl-2-oxoethyl…
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CAS Number: 400087-76-5
| 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) | 1.81 | 1.24 | -45.08 | 0 | 5 | -1 | 79 | 254.287 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 183 - 185 | KeyOrganics |
