COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL012020
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-({5-[3-(2,4-dichlorophenoxy)propyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: N#Cc1c(NC(=O)CSc2nnc(n2c2ccccc2)CCCOc2ccc(cc2Cl)Cl)sc2c1CCCC2

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Molecular Weight: 598.58
Empirical Formula: C28H25Cl2N5O2S2

Physical State: Dry powder
Available Amount: 530 mg

Lipinsky:
logP: 8.353
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 146
Number of rings: 5

     

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