COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473267
Chemical Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-({5-[(3,5-dimethylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCC(C3)C(C)(C)C)nnc1COc1cc(C)cc(c1)C

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Molecular Weight: 549.76
Empirical Formula: C29H35N5O2S2

Physical State: Dry powder
Available Amount: 353 mg

Lipinsky:
logP: 7.781
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 146
Number of rings: 4

     

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