COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL329828
Chemical Name: (5E)-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-1-[4-(propan-2-yl)phenyl]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CC(c1ccc(cc1)N1C(=S)NC(=O)/C(=C\NCCN2CCNCC2)/C1=O)C

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Molecular Weight: 401.53
Empirical Formula: C20H27N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.06
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 108
Number of rings: 3

     

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