COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL229317
Chemical Name: 1-(2,5-dimethoxybenzyl)-3-phenyl-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)urea
Smiles: COc1ccc(c(c1)CN(c1nnc2n1CCCCC2)C(=O)Nc1ccccc1)OC

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Molecular Weight: 421.5
Empirical Formula: C23H27N5O3

Available Amount: 0 mg

Lipinsky:
logP: 3.277
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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