In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 22 | Yes |
Popular Name: N',N'-dimethyl-N-[5-(2,4,6-trimethylphenyl)-1,3,4-thiadiazol-2-yl]butane-1,4-diamine N',N'-dimethyl-N-[5-(2,4,6-trime…
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) | 4.20 | 10.19 | -42.21 | 2 | 4 | 1 | 42 | 319.498 | 7 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US5086053 | IBM Patent Data |