COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780956
Chemical Name: 3-(3-chlorophenyl)-1-(4-ethoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Smiles: CCOc1ccc(cc1)N(C(=O)Nc1cccc(c1)Cl)Cc1nnc2n1CCCCC2

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Molecular Weight: 439.94
Empirical Formula: C23H26ClN5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.782
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 72
Number of rings: 4

     

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