UCSF

ZINC19445397

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 30 Yes

Popular Name: 5-[(1S)-1-[(3-methoxyphenyl)methylamino]-2-methyl-propyl]-2-tetrahydropyran-4-yl-pyrazolo[5,1-b]pyri 5-[(1S)-1-[(3-methoxyphenyl)meth…

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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) 3.37 7.75 -17.35 2 7 0 81 410.518 7 ↓
Hi High (pH 8-9.5) 3.83 6.56 -48.92 1 7 -1 84 409.51 7 ↓
Mid Mid (pH 6-8) 3.37 8.38 -66.45 3 7 1 85 411.526 7 ↓

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

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