COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK613888
Chemical Name: ethyl4-{[(3aS,6R)-1-oxo-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-7-yl]carbonyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)Cc1ccncc1)O2

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Molecular Weight: 426.47
Empirical Formula: C22H26N4O5

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 1.16
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 92
Number of rings: 5

     

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