UCSF

ZINC05931894

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 13 Yes

Popular Name: 3-Methyl-4-(pyrrolidin-1-yl)aniline 3-Methyl-4-(pyrrolidin-1-yl)aniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16089-43-3 , 68155-75-9 , [16089-43-3]

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) 1.90 5.44 -26.67 3 2 1 30 177.271 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 189 - 191 Enamine Building Blocks
MP 189...191 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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