COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172725
Chemical Name: N-({5-[(3-bromobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}methyl)-4-iodoaniline
Smiles: C=CCn1c(nnc1SCc1cccc(c1)Br)CNc1ccc(cc1)I

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Molecular Weight: 541.25
Empirical Formula: C19H18BrIN4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.581
Rotatable bonds: 7
H-donors: 1
H-acceptors: 0
PSA: 68
Number of rings: 3

     

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