COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148774
Chemical Name: N-[(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazin-1-yl)carbonothioyl]thiophene-2-carboxamide
Smiles: S=C(N1CCN(CC1)c1ccc(c(c1)NC(c1ccccc1)C)[N+](=O)[O-])NC(=O)c1cccs1

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Molecular Weight: 495.63
Empirical Formula: C24H25N5O3S2

Physical State: Dry powder
Available Amount: 176 mg

Lipinsky:
logP: 4.765
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 153
Number of rings: 4

     

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