COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK236557
Chemical Name: N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Smiles: CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 522.03
Empirical Formula: C26H24ClN5O3S

Physical State: Dry powder
Available Amount: 829 mg

Lipinsky:
logP: 7.402
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 5

     

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