UCSF

ZINC19094189

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2008 14 Yes

Popular Name: 3-methoxy-4-(1-pyrrolidinyl)aniline 3-methoxy-4-(1-pyrrolidinyl)aniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1186663-17-1 , 16089-42-2

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) 1.50 2.26 -6.56 2 3 0 38 192.262 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0012507A2; EP0012521A2; EP0033200A1; US4088492; US4131468; US4215191; US4219616; US4293633; US4341862; US4363866 IBM Patent Data

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