UCSF

ZINC67741541

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 20 Yes

Popular Name: [(1R,6S)-4,9-diazabicyclo[4.2.1]nonan-4-yl]-(4,5,6,7-tetrahydro-2H-indazol-3-yl)methanone [(1R,6S)-4,9-diazabicyclo[4.2.1]…

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Download: MOL2 SDF SMILES Flexibase

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) 1.47 5.93 -42.52 3 5 1 66 275.376 1 ↓

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Rings

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

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