COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617447
Chemical Name: 6-{[2-butanoyl-4-(methoxycarbonyl)-5,5-dimethyl-3-oxocyclohex-1-en-1-yl]amino}hexanoicacid
Smiles: CCCC(=O)C1=C(NCCCCCC(=O)O)CC(C(C1=O)C(=O)OC)(C)C

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Molecular Weight: 381.47
Empirical Formula: C20H31NO6

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: 2.587
Rotatable bonds: 12
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 1

     

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