COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177454
Chemical Name: 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-yn-1-yl3-chloro-1-benzothiophene-2-carboxylate
Smiles: O=C(c1sc2c(c1Cl)cccc2)OCC#CCSc1nc2c(o1)cccc2

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Molecular Weight: 413.9
Empirical Formula: C20H12ClNO3S2

Physical State: Dry powder
Available Amount: 516 mg

Lipinsky:
logP: 7.953
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 105
Number of rings: 4

     

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