COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK189455
Chemical Name: (5Z)-1-(3-chloro-2-methylphenyl)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C\c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])c1cccc(c1C)Cl

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Molecular Weight: 467.89
Empirical Formula: C22H14ClN3O5S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.337
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 140
Number of rings: 4

     

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