COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446750
Chemical Name: N-[2-(1,3-benzodioxol-5-ylamino)-1-(cyclohex-3-en-1-yl)-2-oxoethyl]-2-(1H-benzotriazol-1-yl)-N-(2-methylbenzyl)acetamide
Smiles: O=C(N(C(C(=O)Nc1ccc2c(c1)OCO2)C1CCC=CC1)Cc1ccccc1C)Cn1nnc2c1cccc2

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Molecular Weight: 537.62
Empirical Formula: C31H31N5O4

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 6.744
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 6

     

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