COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530745
Chemical Name: (2S,3R,10bS)-3-[(3,4-dimethoxyphenyl)carbonyl]-2-(thiophen-3-yl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2cscc2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 467.55
Empirical Formula: C27H21N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.717
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 114
Number of rings: 5

     

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