UCSF

ZINC32006932

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 13 Yes

Popular Name: 2-methyl-5-(pyrrolidin-1-yl)aniline 2-methyl-5-(pyrrolidin-1-yl)aniline

Find On: PubMed — Wikipedia — Google

CAS Number: 69131-64-2

Other Names:

MFCD11934750

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) 2.30 3.4 -4.73 2 2 0 29 176.263 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID US4208202; US4294606; US4394156 IBM Patent Data

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