COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333942
Chemical Name: (4R,7S)-3-hydroxy-7-(thiophen-2-yl)-4-(2,4,5-trimethoxyphenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: COc1cc(OC)c(cc1[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(O)n[nH]2)OC

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Molecular Weight: 453.52
Empirical Formula: C23H23N3O5S

Physical State: Dry powder
Available Amount: 473 mg

Lipinsky:
logP: 3.017
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 133
Number of rings: 5

     

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