COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL320631
Chemical Name: 1-({2-[(4-methylphenyl)sulfonyl]pyridin-3-yl}methyl)-4-(pyridin-3-ylmethyl)piperazine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1ncccc1CN1CCN(CC1)Cc1cccnc1

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Saltdata: 2HCl
Molecular Weight: 422.55
Empirical Formula: C23H26N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.52
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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