COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK998477
Chemical Name: propan-2-yl6-amino-4-(2-chlorophenyl)-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
Smiles: N#CC1=C(N)OC(=C(C1c1ccccc1Cl)C(=O)OC(C)C)CSc1nc2CCCCCc2cc1C#N

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Molecular Weight: 535.07
Empirical Formula: C28H27ClN4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.517
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 147
Number of rings: 4

     

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