UCSF

ZINC15772412

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2008 18 Yes

Popular Name: 1-Benzhydrylazetidin-3-one 1-Benzhydrylazetidin-3-one

Find On: PubMed — Wikipedia — Google

CAS Numbers: 118972-99-9 , 40320-60-3 , [40320-60-3]

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) 2.55 7.18 -6.03 0 2 0 20 237.302 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 350-355? Alfa-Aesar
Boiling_Point 350-355° Alfa-Aesar
MP 78 - 80 Enamine Building Blocks
MP 78...80 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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