COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143071
Chemical Name: 4-(2-{[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}ethyl)-N-phenylpiperazine-1-carbothioamide
Smiles: CN1C(=O)N(C)C(=O)C(=CNCCN2CCN(CC2)C(=S)Nc2ccccc2)C1=O

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Molecular Weight: 430.53
Empirical Formula: C20H26N6O3S

Physical State: Dry powder
Available Amount: 381 mg

Lipinsky:
logP: -0.761
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 120
Number of rings: 3

     

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