UCSF

ZINC19450698

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 5-[(1R)-1-[(4-isopropoxyphenyl)methylamino]ethyl]-2-tetrahydropyran-4-yl-pyrazolo[5,1-b]pyrimidin-7- 5-[(1R)-1-[(4-isopropoxyphenyl)m…

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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) 3.38 7.42 -20.74 2 7 0 81 410.518 7 ↓
Hi High (pH 8-9.5) 3.84 6.29 -46.82 1 7 -1 84 409.51 7 ↓
Lo Low (pH 4.5-6) 3.38 8.72 -73.7 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.