UCSF

ZINC49588672

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 10 Yes

Popular Name: Octahydro-1H-4,7-methanoindene Octahydro-1H-4,7-methanoindene

Find On: PubMed — Wikipedia — Google

CAS Numbers: 281-23-6 , 2825-82-3 , 2825-83-4 , 6004-38-2 , 85-43-8 , 93962-84-6 , [2825-83-4] , [6004-38-2] , [85-43-8]

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) 3.24 6.92 -0.23 0 0 0 0 136.238 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 192 TCI
MP 75 TCI
PUBCHEM_PATENT_ID EP0161112A2; EP0491143A1; US3971804; US4570024; US4997586; US5235079; US5280009; US5312480; US5328769 IBM Patent Data
PUBCHEM_PATENT_ID EP0161112A2; US4570024; US4997586; US5128358; US5196426; US5280009; US5294730; US5414127 IBM Patent Data

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