COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706033
Chemical Name: 1-[3-(diethylamino)propyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-[4-(dimethylamino)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCCN1C(c2ccc(cc2)N(C)C)C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2)CC

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Molecular Weight: 493.6
Empirical Formula: C28H35N3O5

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 4.415
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 82
Number of rings: 4

     

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