COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385665
Chemical Name: 4-[(Z)-(2-cyclohexyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-ethoxyphenyl3-nitrobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1cccc(c1)[N+](=O)[O-])/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1

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Molecular Weight: 547.59
Empirical Formula: C27H25N5O6S

Physical State: Dry powder
Available Amount: 182 mg

Lipinsky:
logP: 4.706
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 175
Number of rings: 5

     

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