COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK336224
Chemical Name: 3-[({[5-{1-[(furan-2-ylcarbonyl)amino]ethyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1C(NC(=O)c1ccco1)C

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Molecular Weight: 455.49
Empirical Formula: C21H21N5O5S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.172
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 164
Number of rings: 3

     

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