COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266143
Chemical Name: 1-[(4-bromophenoxy)methyl]-N-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: COc1ccc(cc1)NC(=S)c1c(c2ccccc2)c2c3n1nc(n3CCCC2)COc1ccc(cc1)Br

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Molecular Weight: 587.54
Empirical Formula: C30H27BrN4O2S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 7.21
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 6

     

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