COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL240665
Chemical Name: (2E)-4-oxo-4-{[2-(piperidin-1-ylsulfonyl)ethyl](pyridin-4-ylmethyl)amino}but-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCCC1

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Molecular Weight: 381.45
Empirical Formula: C17H23N3O5S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 0.422
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 2

     

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