COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK138466
Chemical Name: ethyl4-[({3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}carbamothioyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)NCCCN1CCN(CC1)c1ccc(cc1)F

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Molecular Weight: 444.57
Empirical Formula: C23H29FN4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.027
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 88
Number of rings: 3

     

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