COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK720352
Chemical Name: 10,10-dimethyl-3-[(4-nitrobenzyl)sulfanyl]-5-(propylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)[N+](=O)[O-])nn2)CC(OC3)(C)C

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Molecular Weight: 501.65
Empirical Formula: C22H23N5O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.734
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 176
Number of rings: 5

     

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