COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564031
Chemical Name: (5E)-1-(3-methylphenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NN2CCCCC2c2cccnc2)/C1=O)S

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Molecular Weight: 421.52
Empirical Formula: C22H23N5O2S

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 2.343
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 116
Number of rings: 4

     

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