COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266633
Chemical Name: 1-(4-chlorophenyl)-4-(4-methylphenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: C=CCNC(=S)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

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Molecular Weight: 460.04
Empirical Formula: C27H26ClN3S

Available Amount: 0 mg

Lipinsky:
logP: 7.739
Rotatable bonds: 3
H-donors: 1
H-acceptors: 0
PSA: 53
Number of rings: 5

     

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