COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444500
Chemical Name: methyl2-{[(2,6-dimethoxyphenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COc1cccc(c1C(=O)Nc1sc2c(c1C(=O)OC)CCCCCC2)OC

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Molecular Weight: 403.5
Empirical Formula: C21H25NO5S

Physical State: Dry powder
Available Amount: 990 mg

Lipinsky:
logP: 6.186
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 3

     

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