COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL009115
Chemical Name: (4R,7S)-3-hydroxy-4-(4-hydroxyphenyl)-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: Oc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(O)n[nH]2

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Molecular Weight: 379.44
Empirical Formula: C20H17N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 2.698
Rotatable bonds: 2
H-donors: 4
H-acceptors: 3
PSA: 126
Number of rings: 5

     

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