COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL267242
Chemical Name: 1-{[(3-chloro-2-methylphenyl)amino]methyl}-N-(3-chlorophenyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Clc1cccc(c1)NC(=S)c1c(c2ccccc2)c2c3n1nc(n3CCCC2)CNc1cccc(c1C)Cl

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Molecular Weight: 560.55
Empirical Formula: C30H27Cl2N5S

Available Amount: 0 mg

Lipinsky:
logP: 8.309
Rotatable bonds: 3
H-donors: 2
H-acceptors: 0
PSA: 78
Number of rings: 6

     

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