COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK205942
Chemical Name: 5-{4-[(4-tert-butylphenyl)sulfonyl]piperazin-1-yl}-2-nitro-N-(pyridin-3-ylmethyl)aniline
Smiles: [O-][N+](=O)c1ccc(cc1NCc1cccnc1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 509.63
Empirical Formula: C26H31N5O4S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 5.734
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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