COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685003
Chemical Name: 4-(4-nitrophenyl)-5,6-dihydro-4H-[1,3]dioxolo[4,5-h]pyrrolo[1,2-a][1,4]benzodiazepine
Smiles: [O-][N+](=O)c1ccc(cc1)C1NCc2c(n3c1ccc3)cc1c(c2)OCO1

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Saltdata: HCl
Molecular Weight: 349.35
Empirical Formula: C19H15N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.962
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 5

     

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