COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK975733
Chemical Name: 3,3-dimethyl-8-(morpholin-4-yl)-6-[(4-nitrobenzyl)sulfanyl]-3,4-dihydro-1H-isochromene-5-carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)[N+](=O)[O-])cc(c2c1CC(C)(C)OC2)N1CCOCC1

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Molecular Weight: 439.54
Empirical Formula: C23H25N3O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.618
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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