COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK441405
Chemical Name: methyl6-tert-butyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C2c3ccccc3Oc3c2cccc3)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 475.61
Empirical Formula: C28H29NO4S

Physical State: Dry powder
Available Amount: 600 mg

Lipinsky:
logP: 8.07
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 5

     

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