COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK106440
Chemical Name: 4-[(2-{(E)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzoicacid
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/c1ccccc1OCc1ccc(cc1)C(=O)O)c1cccc(c1C)C

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Molecular Weight: 486.55
Empirical Formula: C27H22N2O5S

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 5.513
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 128
Number of rings: 4

     

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