COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK872351
Chemical Name: 4-tert-butyl-N-[(2E)-3-cyano-1-(3-methoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]benzamide
Smiles: COCCCn1/c(=N/C(=O)c2ccc(cc2)C(C)(C)C)/c(C#N)cc2c1nc1c(C)cccn1c2=O

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Molecular Weight: 483.57
Empirical Formula: C28H29N5O3

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 3.302
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 4

     

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