COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL331596
Chemical Name: dimethyl2-({(2E)-3-[4-(hexyloxy)-3-methoxyphenyl]prop-2-enoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Smiles: CCCCCCOc1ccc(cc1OC)/C=C/C(=O)Nc1sc2c(c1C(=O)OC)C(CC2)C(=O)OC

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Molecular Weight: 515.63
Empirical Formula: C27H33NO7S

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 7.689
Rotatable bonds: 13
H-donors: 1
H-acceptors: 7
PSA: 128
Number of rings: 3

     

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