COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK263564
Chemical Name: N-{(E)-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)amino][(3-methylphenyl)amino]methylidene}-2-phenylbutanamide
Smiles: CCC(c1ccccc1)C(=O)/N=C(/Nc1nc(CSc2ccc(cc2)Cl)cc(=O)[nH]1)\Nc1cccc(c1)C

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Molecular Weight: 546.09
Empirical Formula: C29H28ClN5O2S

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 7.261
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 120
Number of rings: 4

     

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