COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290833
Chemical Name: 4-(4,8-diethoxy-1,3-dimethyl-6H-cyclohepta[c]furan-6-ylidene)-2-hydroxycyclohexa-2,5-dien-1-one
Smiles: CCOC1=C/C(=C/2\C=CC(=O)C(=C2)O)/C=C(c2c1c(C)oc2C)OCC

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Molecular Weight: 354.4
Empirical Formula: C21H22O5

Available Amount: 0 mg

Lipinsky:
logP: 4.078
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 68
Number of rings: 3

     

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