COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL530530
Chemical Name: N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC(=O)CN2C(=O)c3c(C2=O)cccc3)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 571.59
Empirical Formula: C31H29N3O8

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.06
Rotatable bonds: 4
H-donors: 2
H-acceptors: 8
PSA: 140
Number of rings: 5

     

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