COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK616495
Chemical Name: 4-[3-{3-[(methylsulfonyl)amino]phenyl}-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cccs1)c1cccc(c1)NS(=O)(=O)C

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Molecular Weight: 421.5
Empirical Formula: C18H19N3O5S2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: -0.124
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 152
Number of rings: 3

     

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