COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL034012
Chemical Name: 20-ethyl-16-methoxy-4-methylaconitane-1,8,14-triol
Smiles: CCN1CC2(C)CCC(C34C1C(CC23)C1(O)CC(C2CC4C1C2O)OC)O

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Saltdata: HCl
Molecular Weight: 377.52
Empirical Formula: C22H35NO4

Physical State: Dry powder
Available Amount: 1003 mg

Lipinsky:
logP: -0.262
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 73
Number of rings: 6

     

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