COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832347
Chemical Name: (7E)-2-[(4-nitrobenzyl)sulfanyl]-4-(thiophen-2-yl)-7-(thiophen-2-ylmethylidene)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1c1cccs1)CC/C/2=C\c1cccs1

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Molecular Weight: 487.63
Empirical Formula: C25H17N3O2S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.437
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 164
Number of rings: 5

     

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