COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533453
Chemical Name: ethyl4-[(3S,3a'R,8a'S,8b'S)-7-ethyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2CC

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Molecular Weight: 473.53
Empirical Formula: C27H27N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.213
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 6

     

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