COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446375
Chemical Name: 3-(4-bromophenyl)-3-deoxy-2,4-bis-S-(4-methylphenyl)-1,5-diphenyl-2,4-dithiopentodialdose
Smiles: Brc1ccc(cc1)C(C(C(=O)c1ccccc1)Sc1ccc(cc1)C)C(C(=O)c1ccccc1)Sc1ccc(cc1)C

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Molecular Weight: 651.69
Empirical Formula: C37H31BrO2S2

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 11.977
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 84
Number of rings: 5

     

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