COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK452534
Chemical Name: propyl2-{[(4-bromophenyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Br)sc2c1CCCCC2

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Molecular Weight: 450.4
Empirical Formula: C21H24BrNO3S

Physical State: Dry powder
Available Amount: 3324 mg

Lipinsky:
logP: 7.247
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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