COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444484
Chemical Name: 1-[(4-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)sulfonyl]piperidine
Smiles: COc1cc(ccc1OC)C1CC(=NN1c1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1cccs1

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Saltdata: HBr
Molecular Weight: 594.78
Empirical Formula: C29H30N4O4S3

Physical State: Dry powder
Available Amount: 415 mg

Lipinsky:
logP: 4.162
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 149
Number of rings: 6

     

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