COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK720338
Chemical Name: 2-{[5-(benzylsulfanyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CC(C)(C)OCc2s1

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Molecular Weight: 567.16
Empirical Formula: C27H23ClN4O2S3

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 9.105
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 148
Number of rings: 6

     

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