COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733726
Chemical Name: ethyl8-(4-ethylphenyl)-1-(2-nitrophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)C=CC(=NN2c1ccccc1)c1ccc(cc1)CC)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 527.6
Empirical Formula: C28H25N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.4
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 128
Number of rings: 5

     

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