COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834071
Chemical Name: (4R)-5-acetyl-6-methyl-4-(2-nitrophenyl)-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-1,4-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)C23CC4CC(C3)CC(C2)C4)NC(=C([C@H]1c1ccccc1[N+](=O)[O-])C(=O)C)C

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Molecular Weight: 491.61
Empirical Formula: C27H29N3O4S

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 4.954
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 141
Number of rings: 6

     

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