COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681023
Chemical Name: 4-(4-bromophenyl)-N-(3-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Brc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1cccc(c1)C)nc3c1ccccc1

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Molecular Weight: 541.51
Empirical Formula: C29H25BrN4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.165
Rotatable bonds: 1
H-donors: 1
H-acceptors: 0
PSA: 66
Number of rings: 6

     

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