COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK679040
Chemical Name: 3-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Smiles: COc1ccc(cc1)N(C(=O)Nc1ccc(c(c1)Cl)Cl)Cc1nnc2n1CCCCC2

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Molecular Weight: 460.36
Empirical Formula: C22H23Cl2N5O2

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 4.116
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 72
Number of rings: 4

     

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