COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL451721
Chemical Name: 1-{[(3-chloro-2-methylphenyl)amino]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)CNc1cccc(c1C)Cl

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Molecular Weight: 556.13
Empirical Formula: C31H30ClN5OS

Available Amount: 0 mg

Lipinsky:
logP: 7.228
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 87
Number of rings: 6

     

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