COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438772
Chemical Name: N-{2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-[4-(propan-2-yl)phenyl]ethyl}-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(pyridin-3-ylmethyl)acetamide
Smiles: Cc1nc(SCC(=O)N(C(C(=O)Nc2ccc3c(c2)OCO3)c2ccc(cc2)C(C)C)Cc2cccnc2)nc(c1)C

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Molecular Weight: 583.71
Empirical Formula: C32H33N5O4S

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 6.289
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 131
Number of rings: 5

     

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