COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK558082
Chemical Name: (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C)[N+](=O)[O-])/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 437.44
Empirical Formula: C20H15N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.926
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 177
Number of rings: 3

     

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