In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 13 | No |
Popular Name: Ethyl 2-mercapto-4-methylpyrimidine-5-carboxylate Ethyl 2-mercapto-4-methylpyrimid…
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CAS Numbers: 81633-30-9 , [81633-30-9]
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) | 1.14 | 4.43 | -41.79 | 0 | 4 | -1 | 52 | 197.239 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 4.83 | -17.95 | 1 | 4 | 0 | 55 | 198.247 | 3 | ↓ |