COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265019
Chemical Name: 1-(4-bromophenyl)-4-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
Smiles: COc1cc(ccc1OC)c1cn2c3c1CCCCn3c(n2)c1ccc(cc1)Br

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Molecular Weight: 452.35
Empirical Formula: C23H22BrN3O2

Available Amount: 0 mg

Lipinsky:
logP: 6.717
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 40
Number of rings: 5

     

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