COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372290
Chemical Name: 3-({(E)-[5-nitro-2-(piperidin-1-yl)phenyl]methylidene}amino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1n(/N=C/c2cc(ccc2N2CCCCC2)[N+](=O)[O-])cnc2c1c1CCCCc1s2

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Molecular Weight: 437.52
Empirical Formula: C22H23N5O3S

Physical State: Dry powder
Available Amount: 367 mg

Lipinsky:
logP: 5.431
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 122
Number of rings: 5

     

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