COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177310
Chemical Name: 4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methylidene-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
Smiles: CN(C1C(=C(C(=O)N)C(=O)C2(C1C(O)C1C(=C)c3cccc(c3C(=O)C1=C2O)O)O)O)C

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Saltdata: HCI
Molecular Weight: 442.43
Empirical Formula: C22H22N2O8

Physical State: Dry powder
Available Amount: 1945 mg

Lipinsky:
logP: -0.689
Rotatable bonds: 6
H-donors: 7
H-acceptors: 8
PSA: 181
Number of rings: 4

     

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