COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687144
Chemical Name: methyl2-{[(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)Cn2nc(c(c2C)I)C)sc2c1CCCC2

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Molecular Weight: 473.33
Empirical Formula: C17H20IN3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.712
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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