UCSF

ZINC04202928

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 15 Yes

Popular Name: (S)-1-benzyl-pyrrolidine-3-carboxylic acid (S)-1-benzyl-pyrrolidine-3-carbo…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1212293-24-7 , 161659-80-9 , 216311-57-8 , 5731-18-0 , 608142-09-2 , [161659-80-9] , [5731-18-0] , [608142-09-2]

Download: MOL2 SDF SMILES Flexibase

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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) 1.49 6.81 -58.04 1 3 0 45 205.257 3 ↓
Hi High (pH 8-9.5) 0.88 2.55 -48.06 0 3 -1 49 155.173 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific
Warnings IRRITANT, HYGROSCOPIC Matrix Scientific
Warnings Irritant/Hygroscopic/Refrigerate Matrix Scientific

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