COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK830486
Chemical Name: 1-(4-bromophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
Smiles: COc1ccc(cc1)c1cn2c3c1CCCCn3c(n2)c1ccc(cc1)Br

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Molecular Weight: 422.32
Empirical Formula: C22H20BrN3O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.045
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 31
Number of rings: 5

     

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