COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457514
Chemical Name: methyl2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylcarbonothioyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCC3(CC2)OCCO3)sc2c1CCCCCC2

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Molecular Weight: 424.59
Empirical Formula: C20H28N2O4S2

Physical State: Dry powder
Available Amount: 620 mg

Lipinsky:
logP: 5.427
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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