COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832346
Chemical Name: methyl4-({[(7E)-3-cyano-4-(thiophen-2-yl)-7-(thiophen-2-ylmethylidene)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)CSc1nc2/C(=C/c3cccs3)/CCc2c(c1C#N)c1cccs1

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Molecular Weight: 500.67
Empirical Formula: C27H20N2O2S3

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 7.685
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 144
Number of rings: 5

     

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