COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL033990
Chemical Name: 9-chloro-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one
Smiles: COc1cc(cc(c1OC)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)Cl

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Molecular Weight: 432.86
Empirical Formula: C22H21ClO7

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 2.5
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 72
Number of rings: 5

     

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