COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK686431
Chemical Name: N-cyclohexyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-8,11-dioxo-2-oxa-9,12-diazatricyclo[13.3.1.1~3,7~]icosa-1(19),3(20),4,6,15,17-hexaene-13-carboxamide
Smiles: COc1ccc(cc1OC)CCN1CC(=O)NC(Cc2cccc(Oc3cc(C1=O)ccc3[N+](=O)[O-])c2)C(=O)NC1CCCCC1

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Molecular Weight: 630.7
Empirical Formula: C34H38N4O8

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 3.617
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 152
Number of rings: 5

     

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