COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545807
Chemical Name: (2S)-({N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]glycyl}amino)(phenyl)ethanoicacid
Smiles: COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCC(=O)N[C@@H](c1ccccc1)C(=O)O)NC(=O)C

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Molecular Weight: 575.62
Empirical Formula: C31H33N3O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.879
Rotatable bonds: 8
H-donors: 4
H-acceptors: 8
PSA: 152
Number of rings: 4

     

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