COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529237
Chemical Name: (7S)-10-{[2-(4-fluorophenyl)ethyl]amino}-7-[(2-hydroxybenzyl)(methyl)amino]-1,2,3-trimethoxy-6,7-dihydrobenzo[a]heptalen-9(5H)-one
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCc2ccc(cc2)F)N(Cc2ccccc2O)C)cc(c1OC)OC

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Molecular Weight: 584.69
Empirical Formula: C35H37FN2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.295
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 80
Number of rings: 5

     

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