COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548858
Chemical Name: N-[(7S)-1,2,3-trimethoxy-9-oxo-10-({2-oxo-2-[8-(trifluoromethoxy)-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl]ethyl}amino)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)N2CCc3c(C2)c2cc(ccc2[nH]3)OC(F)(F)F)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 680.68
Empirical Formula: C35H35F3N4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.431
Rotatable bonds: 6
H-donors: 3
H-acceptors: 7
PSA: 131
Number of rings: 6

     

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