| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 14 | No |
Popular Name: 3-(5-Mercapto-1,3,4-oxadiazol-2-yl)benzonitrile 3-(5-Mercapto-1,3,4-oxadiazol-2-…
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CAS Numbers: 203268-77-3 , [203268-77-3]
| 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) | 2.06 | 1.32 | -41.95 | 0 | 4 | -1 | 63 | 202.218 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.33 | 2.11 | -14.71 | 1 | 4 | 0 | 66 | 203.226 | 1 | ↓ |
