UCSF

ZINC52827986

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 22 Yes

Popular Name: 6-[[cyclopropyl-[[(3R)-tetrahydrofuran-3-yl]methyl]amino]methyl]-1-methyl-5H-pyrazolo[3,4-d]pyrimidi 6-[[cyclopropyl-[[(3R)-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) 0.75 3.02 -49.59 1 7 0 80 303.366 5 ↓
Mid Mid (pH 6-8) 0.30 3.82 -12.08 1 7 0 76 303.366 5 ↓
Mid Mid (pH 6-8) 0.30 5.82 -53.9 2 7 1 77 304.374 5 ↓

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

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