COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533893
Chemical Name: (2E)-3-[3-(azepan-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)N1CCCCCC1

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Molecular Weight: 369.44
Empirical Formula: C17H23NO6S

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: 3.379
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 101
Number of rings: 2

     

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