COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034097
Chemical Name: N-[4-({4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}sulfonyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[N+](=O)[O-]

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Molecular Weight: 535.62
Empirical Formula: C27H29N5O5S

Physical State: Dry powder
Available Amount: 136 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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