COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548125
Chemical Name: N-[(7S)-10-{[(2S)-1-(3,4-dihydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)N2CCc3c(C2)cccc3)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 571.67
Empirical Formula: C33H37N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.903
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 106
Number of rings: 5

     

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