COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL519384
Chemical Name: N-{4-oxo-4-[(3,4,5-trimethoxyphenyl)amino]butyl}-1,3,4,9-tetrahydro-2H-beta-carboline-2-carboxamide
Smiles: COc1cc(NC(=O)CCCNC(=O)N2CCc3c(C2)[nH]c2c3cccc2)cc(c1OC)OC

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Molecular Weight: 466.54
Empirical Formula: C25H30N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.042
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 104
Number of rings: 4

     

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