COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705997
Chemical Name: 1-[3-(diethylamino)propyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCCN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2)CC

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Molecular Weight: 495.53
Empirical Formula: C26H29N3O7

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 4.036
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 125
Number of rings: 4

     

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