COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL058060
Chemical Name: N-{[4-(1,3-benzodioxol-5-ylcarbamoyl)cyclohexyl]methyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C(C1CCC(CC1)CNC(=O)C1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCO2

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Saltdata: HCl
Molecular Weight: 435.52
Empirical Formula: C25H29N3O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.506
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 88
Number of rings: 5

     

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