COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528083
Chemical Name: (12aR)-2-(2-methylpropyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@H]2Cc2c1[nH]c1c2cccc1)CC(C)C

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Molecular Weight: 477.56
Empirical Formula: C27H31N3O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.417
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 5

     

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