COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK094749
Chemical Name: ethyl(2E)-4-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}-4-oxobut-2-enoate
Smiles: CCOC(=O)/C=C/C(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

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Molecular Weight: 366.44
Empirical Formula: C20H18N2O3S

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 4.543
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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