UCSF

ZINC62509339

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 2nd, 2011 24 Yes

Popular Name: 3-tert-butyl-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-5-methyl-isoxazole-4-carboxamide 3-tert-butyl-N-(2-imidazo[1,5-a]…

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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) 2.79 8.31 -15.62 1 6 0 72 326.4 5 ↓
Lo Low (pH 4.5-6) 2.79 8.74 -41.49 2 6 1 74 327.408 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.