COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529167
Chemical Name: N-[(7S)-1,2,3-trimethoxy-9-oxo-10-{4-[(E)-2-phenylethenyl]piperazin-1-yl}-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N2CCN(CC2)/C=C/c2ccccc2)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 555.67
Empirical Formula: C33H37N3O5

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.961
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 5

     

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