COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529419
Chemical Name: (12bS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 597.71
Empirical Formula: C35H39N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.635
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 93
Number of rings: 6

     

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