COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK752025
Chemical Name: 6-tert-butyl-2-{[(E)-(5-nitrothiophen-2-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(s2)[N+](=O)[O-])sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 373.5
Empirical Formula: C18H19N3O2S2

Physical State: Dry powder
Available Amount: 35 mg

Lipinsky:
logP: 5.557
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 138
Number of rings: 3

     

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