COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605550
Chemical Name: (3S)-N-{(2S)-1-[(2,4-dimethylphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)Cc1ccccc1

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Saltdata: HCl
Molecular Weight: 427.55
Empirical Formula: C27H29N3O2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.306
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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