COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL441015
Chemical Name: 1-(heptylsulfanyl)-4-(4-methoxyphenyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)C(C)C

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Molecular Weight: 526.72
Empirical Formula: C27H34N4O3S2

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 8.095
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 5

     

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