COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545981
Chemical Name: 1-[8-(2,5-dimethylphenyl)-1-(2-nitrophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-yl]ethanone
Smiles: Cc1ccc(c(c1)C1=NN(C2(CC1)SC(=NN2c1ccccc1[N+](=O)[O-])C(=O)C)c1ccccc1)C

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Molecular Weight: 499.59
Empirical Formula: C27H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.797
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 119
Number of rings: 5

     

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