COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417082
Chemical Name: (5E)-1-(3-chloro-4-methylphenyl)-5-(2,3-dihydro-1H-indol-1-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)/C(=C\N2CCc3c2cccc3)/C(=O)N1c1ccc(c(c1)Cl)C

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Molecular Weight: 397.88
Empirical Formula: C20H16ClN3O2S

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 3.598
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 4

     

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