COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552925
Chemical Name: 4-[5-(4-bromophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)Br)c1cccs1

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Molecular Weight: 407.29
Empirical Formula: C17H15BrN2O3S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 1.916
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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