COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546440
Chemical Name: methyl1-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Smiles: COC(=O)C1NC(c2ccc(c(c2)CSc2nc3c(s2)cccc3)OC)c2c(C1)c1ccccc1[nH]2

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Molecular Weight: 515.66
Empirical Formula: C28H25N3O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.943
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 129
Number of rings: 6

     

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