In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 19 | No |
Popular Name: [3-phenyl-2-(p-tolyl)-1,2,4-thiadiazol-2-ium-5-yl]amine [3-phenyl-2-(p-tolyl)-1,2,4-thia…
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) | 0.53 | -1.36 | -22.6 | 2 | 3 | 1 | 42 | 268.365 | 2 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO2000024725A1 | IBM Patent Data |