COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040307
Chemical Name: 4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-7-ium-2-yl)-2,6-dimethoxyphenolate
Smiles: COc1cc(cc(c1[O-])OC)C1N=C(O)c2c(N1)sc1c2CC[NH+](C1)C

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Molecular Weight: 375.45
Empirical Formula: C18H21N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.243
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 118
Number of rings: 4

     

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