UCSF

ZINC00967941

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 11 Yes

Popular Name: 3-(2-aminopropyl)phenol 3-(2-aminopropyl)phenol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1075-61-2 , 18840-47-6

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) 0.82 -3.16 -40.37 4 2 1 47 152.217 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 45 - 47 Enamine Building Blocks
MP 45...47 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP1021204A2; US5446070; US5656286; US5719197; US6024976; US6165500; WO1996040086A2; WO1999015210A2; WO2000048636A1 IBM Patent Data

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