COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK255459
Chemical Name: N-({3-chloro-4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)-4-methoxy-3-nitrobenzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1cccs1

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Molecular Weight: 560.05
Empirical Formula: C24H22ClN5O5S2

Physical State: Dry powder
Available Amount: 651 mg

Lipinsky:
logP: 3.885
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 180
Number of rings: 4

     

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