COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230201
Chemical Name: N-{[5-({2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Smiles: C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nnc1CNC(=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 552.68
Empirical Formula: C26H28N6O4S2

Physical State: Dry powder
Available Amount: 34 mg

Lipinsky:
logP: 4.029
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 184
Number of rings: 4

     

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