UCSF

ZINC12359348

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 17 Yes

Popular Name: (S)-1-(tert-Butoxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid (S)-1-(tert-Butoxycarbonyl)-4,4-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1000313-01-8 , 203866-15-3 , [203866-15-3]

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) -0.07 2.13 -51.01 0 5 -1 70 250.221 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 120-124? Alfa-Aesar
Melting_Point 120-124° Alfa-Aesar
MP 121 - 123 Enamine Building Blocks
MP 121...123 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Fluorochem
Purity 97+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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