COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334714
Chemical Name: 6-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: O=C(C1CC(=C(CC1C(=O)O)C)C)NCc1ccc2c(c1)OCO2

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Molecular Weight: 331.37
Empirical Formula: C18H21NO5

Physical State: Dry powder
Available Amount: 608 mg

Lipinsky:
logP: 2.566
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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