COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529489
Chemical Name: 1-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]piperidine-4-carboxamide
Smiles: COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)N1CCC(CC1)C(=O)N)NC(=O)C

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Molecular Weight: 495.58
Empirical Formula: C27H33N3O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.205
Rotatable bonds: 4
H-donors: 3
H-acceptors: 6
PSA: 120
Number of rings: 4

     

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