COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514711
Chemical Name: 2-amino-3-[(4-bromophenyl)sulfonyl]-4-(4-ethoxy-3-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydro-5H-chromen-5-one
Smiles: CCOc1ccc(cc1OC)C1C2=C(OC(=C1S(=O)(=O)c1ccc(cc1)Br)N)CC(CC2=O)(C)C

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Molecular Weight: 562.48
Empirical Formula: C26H28BrNO6S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 4.694
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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