COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551181
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-L-alaninamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)N(C[C@@H]2CCCN3[C@@H]2CCCC3)C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 620.79
Empirical Formula: C35H48N4O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.5
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 5

     

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