COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006460
Chemical Name: (5Z)-1-(4-bromophenyl)-5-({[2-(dimethylamino)ethyl]amino}methylidene)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN(CCN/C=C/1\C(=O)N(c2ccc(cc2)Br)C(=S)N(C1=O)c1ccccc1)C

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Molecular Weight: 473.39
Empirical Formula: C21H21BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.251
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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