COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL439052
Chemical Name: N-1,3-benzodioxol-5-yl-N~2~-(1H-benzotriazol-1-ylacetyl)-N~2~-(2-methylbenzyl)isovalinamide
Smiles: CCC(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1C)(C(=O)Nc1ccc2c(c1)OCO2)C

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Molecular Weight: 499.57
Empirical Formula: C28H29N5O4

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 5.844
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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