COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383516
Chemical Name: 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cc(ccc1OC)/C=C(/c1nc2c(s1)cccc2)\C#N

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Molecular Weight: 442.49
Empirical Formula: C25H18N2O4S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 6.286
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 109
Number of rings: 4

     

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