COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK464070
Chemical Name: 4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]-N-[4-(morpholin-4-ylsulfonyl)phenyl]piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)C(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])Nc1ccc(cc1)S(=O)(=O)N1CCOCC1

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Molecular Weight: 610.14
Empirical Formula: C24H24ClN5O6S3

Physical State: Dry powder
Available Amount: 487 mg

Lipinsky:
logP: 3.516
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 196
Number of rings: 5

     

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