| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 19 | No |
Popular Name: 5-(dimethylamino)-3-[[ethyl(2-ethylbutyl)amino]methyl]-1,3,4-thiadiazole-2-thione 5-(dimethylamino)-3-[[ethyl(2-et…
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| 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) | 3.13 | 10.3 | -94.96 | 2 | 4 | 2 | 27 | 304.529 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 10.2 | -33.2 | 1 | 4 | 1 | 26 | 303.521 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 8.3 | -7.99 | 0 | 4 | 0 | 24 | 302.513 | 8 | ↓ |
