COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020800
Chemical Name: 4-({6-methyl-3-[(4-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-4-oxobutanoicacid
Smiles: CC1CCc2c(C1)sc(c2C(=O)Nc1ccc(cc1)C)NC(=O)CCC(=O)O

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Molecular Weight: 400.5
Empirical Formula: C21H24N2O4S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 5.066
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 123
Number of rings: 3

     

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