COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381454
Chemical Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenyl4-chlorobenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)Cl)/c1nc2c(s1)cccc2

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Molecular Weight: 416.89
Empirical Formula: C23H13ClN2O2S

Physical State: Dry powder
Available Amount: 191 mg

Lipinsky:
logP: 6.926
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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