UCSF

ZINC69807651

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 24 Yes

Popular Name: (3,6-dimethylisoxazolo[5,4-b]pyridin-4-yl)-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]methanone (3,6-dimethylisoxazolo[5,4-b]pyr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.46 1.34 -11.56 1 7 0 83 332.404 3 ↓
Lo Low (pH 4.5-6) 0.46 3.1 -57.5 2 7 1 84 333.412 3 ↓

Activity (Go SEA)

Rings

Analogs ( Draw Identity 99% 90% 80% 70% )