COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472661
Chemical Name: 1-(4-butylphenyl)-3-[4-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)phenyl]thiourea
Smiles: CCCCc1ccc(cc1)NC(=S)Nc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 479.67
Empirical Formula: C26H29N3O2S2

Physical State: Dry powder
Available Amount: 366 mg

Lipinsky:
logP: 6.214
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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