UCSF

ZINC13542620

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 16 Yes

Popular Name: 4-[[(2-FURANYL)METHYL]AMINO]-1H-PYRAZOLO[3,4-D]PYRIMIDINE 4-[[(2-FURANYL)METHYL]AMINO]-1H-…

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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) 0.66 4.11 -8.26 2 6 0 80 215.216 3 ↓
Mid Mid (pH 6-8) 0.39 3.4 -32.12 0 6 -1 77 214.208 3 ↓
Lo Low (pH 4.5-6) 0.39 4.7 -53.89 2 6 1 76 216.224 3 ↓

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

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