| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 8th, 2011 | 26 | Yes |
Popular Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]urea 1-(5-tert-butyl-1,3,4-thiadiazol…
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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) | 3.06 | 7.64 | -49.07 | 3 | 7 | 1 | 81 | 378.522 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 5.16 | -17.36 | 2 | 7 | 0 | 79 | 377.514 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
