COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK755756
Chemical Name: 2-({(E)-[4-(dimethylamino)-3-nitrophenyl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(c(c2)[N+](=O)[O-])N(C)C)sc2c1CCCC2

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Molecular Weight: 354.43
Empirical Formula: C18H18N4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.444
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 113
Number of rings: 3

     

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