COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529052
Chemical Name: ethyl4-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 525.6
Empirical Formula: C28H35N3O7

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.433
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 106
Number of rings: 4

     

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