COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110975
Chemical Name: (5E)-1-(3-chloro-2-methylphenyl)-5-{[1-(3-methylbenzyl)-1H-indol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1C)Cl

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Molecular Weight: 500.02
Empirical Formula: C28H22ClN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.8
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 5

     

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