COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL481855
Chemical Name: N-{4-[5-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]phenyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C)nnc1c1ccc(cc1)NC(=O)c1csc2c1CCCC2

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Molecular Weight: 543.71
Empirical Formula: C29H29N5O2S2

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 7.356
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 142
Number of rings: 5

     

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