COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052151
Chemical Name: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C/Nc2ccc3c(c2)CCC3)/C(=O)N1CCC1=CCCCC1

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Molecular Weight: 395.53
Empirical Formula: C22H25N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.892
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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