UCSF

ZINC21958378

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 14 Yes

Popular Name: 1-(3-amino-2-methylphenyl)pyrrolidin-2-one 1-(3-amino-2-methylphenyl)pyrrol…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 69131-43-7 , [69131-43-7]

Other Names:

AN-3175

MFCD09044451

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) 1.14 4.75 -11.95 2 3 0 46 190.246 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 170 - 172 Enamine Building Blocks
MP 170...172 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US4208202; US4294606; US4394156 IBM Patent Data

Activity (Go SEA)

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