COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL320622
Chemical Name: 5-(azepan-1-ylmethyl)-2-hydroxy-3-({4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}methyl)-4H-pyran-4-one
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1c(O)occ(c1=O)CN1CCCCCC1

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Molecular Weight: 491.61
Empirical Formula: C24H33N3O6S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 4.431
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 108
Number of rings: 4

     

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