COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681020
Chemical Name: methyl4-(2-amino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutanoate
Smiles: COC(=O)CCC(=O)C1=C(N)CC(CC1=O)(C)C

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Molecular Weight: 253.3
Empirical Formula: C13H19NO4

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 0.792
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 86
Number of rings: 1

     

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