COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596693
Chemical Name: (2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccs1)C(=O)Nc1c2cccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 547.59
Empirical Formula: C31H21N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.307
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 140
Number of rings: 7

     

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