COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK418529
Chemical Name: 2-(3-bromophenyl)-N-(3-carbamoyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)quinoline-4-carboxamide
Smiles: Brc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2

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Molecular Weight: 534.48
Empirical Formula: C27H24BrN3O2S

Physical State: Dry powder
Available Amount: 542 mg

Lipinsky:
logP: 8.095
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 113
Number of rings: 5

     

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