COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993290
Chemical Name: (3E)-4-(4-chlorophenyl)-1-(1,3-dithiolan-2-ylidene)but-3-en-2-one
Smiles: O=C(C=C1SCCS1)/C=C/c1ccc(cc1)Cl

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Molecular Weight: 282.81
Empirical Formula: C13H11ClOS2

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 4.831
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 67
Number of rings: 2

     

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