COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL010196
Chemical Name: 3,9-bis(furan-2-ylmethyl)-12-(2-methoxyphenyl)-6-thioxo-3,4,9,10-tetrahydro-2H-7,11-methano[1,3,5]triazino[1,2-a][1,5]diazocine-7,11(6H,8H)-dicarbonitrile
Smiles: COc1ccccc1C1C2(C#N)CN(CC1(C#N)C1=NCN(CN1C2=S)Cc1ccco1)Cc1ccco1

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Molecular Weight: 526.62
Empirical Formula: C28H26N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.382
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 137
Number of rings: 6

     

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