COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446822
Chemical Name: 2-(1H-benzotriazol-1-yl)-N-[1-(cyclohex-3-en-1-yl)-2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl]-N-(2-methylbenzyl)acetamide
Smiles: CN(c1ccc(cc1)NC(=O)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1C)C1CCC=CC1)C

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Molecular Weight: 536.68
Empirical Formula: C32H36N6O2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 6.603
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 83
Number of rings: 5

     

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