COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448381
Chemical Name: 3-[3-(azepan-1-yl)-2-hydroxypropyl]-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Smiles: OC(C[n+]1nn(c(c1C(=O)Nc1ccccc1)[O-])c1ccccc1)CN1CCCCCC1

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Molecular Weight: 435.53
Empirical Formula: C24H29N5O3

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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