COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK231632
Chemical Name: N-[6-({[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioyl}amino)-1,3-benzothiazol-2-yl]butanamide
Smiles: CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=S)NC(=O)/C=C/c1ccc(cc1)OC

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Molecular Weight: 454.57
Empirical Formula: C22H22N4O3S2

Physical State: Dry powder
Available Amount: 559 mg

Lipinsky:
logP: 4.428
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 152
Number of rings: 3

     

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