COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551422
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-{2-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}-L-isoleucinamide
Smiles: CC[C@H]([C@@H](C(=O)NCCc1onc(n1)c1ccco1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C

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Molecular Weight: 659.74
Empirical Formula: C35H41N5O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.758
Rotatable bonds: 10
H-donors: 3
H-acceptors: 8
PSA: 167
Number of rings: 5

     

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