COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL483887
Chemical Name: 1-(dimethylamino)-1-phenyl-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)propan-2-one
Smiles: CN(C(c1ccccc1)C(=O)CSc1nnc2n1CCCCC2)C

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Saltdata: HCI
Molecular Weight: 344.48
Empirical Formula: C18H24N4OS

Available Amount: 0 mg

Lipinsky:
logP: 4.069
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 3

     

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