COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360616
Chemical Name: ethyl2-{[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C/2\Sc3c(C2=O)cccc3)sc2c1CCCCC2

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Molecular Weight: 399.53
Empirical Formula: C21H21NO3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.798
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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