COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169923
Chemical Name: 6-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 524
Empirical Formula: C25H22ClN5O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.219
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 144
Number of rings: 5

     

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