UCSF

ZINC49410013

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 23 Yes

Popular Name: 3-(2-pyridyl)-6-[[(2S)-tetrahydrofuran-2-yl]methyl]-4H-isothiazolo[4,5-d]pyrimidine-5,7-dione 3-(2-pyridyl)-6-[[(2S)-tetrahydr…

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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) 1.28 2.8 -47.93 0 7 -1 93 329.361 3 ↓
Lo Low (pH 4.5-6) 0.82 4.85 -9.82 1 7 0 90 330.369 3 ↓

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

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