UCSF

ZINC66054675

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 26 Yes

Popular Name: 1-BOC-2'-TERT-BUTYL-7'-OXO-6',7'-DIHYDRO-1H,2'H-SPIRO[PIPERIDINE-4,5'-PYRANO[3,2-C]PYRAZOLE] 1-BOC-2'-TERT-BUTYL-7'-OXO-6',7'…

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CAS Numbers: 1197815-67-0 , N/A

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) 2.98 7.82 -14.03 0 7 0 74 363.458 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

Rings

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

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