| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 30 | No |
Popular Name: 4-methylbenzyl 1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate 4-methylbenzyl 1-(4-methylphenyl…
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CAS Numbers: 1291871-29-8 , [1291871-29-8]
4-methylbenzyl 1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate 4,4-dioxide
| 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) | 4.21 | 9.82 | -15.84 | 0 | 7 | 0 | 89 | 421.478 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.21 | 10.12 | -45.2 | 1 | 7 | 1 | 90 | 422.486 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrido[2,3-e][1,3,4]thiadiazine 4,4-dioxide](http://zinc12.docking.org/img/rings/503115.gif)
![4,4-diketo-1-phenyl-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylic Acid Benzyl Ester](http://zinc12.docking.org/img/rings/507975.gif)