COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540862
Chemical Name: ethyl4-{N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-alanyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C

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Molecular Weight: 596.68
Empirical Formula: C31H40N4O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.941
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 135
Number of rings: 4

     

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