UCSF

ZINC03732341

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 13 Yes

Popular Name: 2-(2-Phenylethyl)pyrrolidine 2-(2-Phenylethyl)pyrrolidine

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CAS Numbers: 106366-30-7 , 936225-51-3

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) 2.81 7.09 -40.66 2 1 1 17 176.283 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
MP 98 - 100 Enamine Building Blocks
MP 98...100 Enamine Building Blocks
PUBCHEM_PATENT_ID EP1001933A1; US4225608; WO1999006367A1 IBM Patent Data

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