UCSF

ZINC02555149

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 9 Yes

Popular Name: 4-Amino-3-fluorophenol 4-Amino-3-fluorophenol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 18266-53-0 , 399-95-1 , [18266-53-0] , [399-95-1]

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) 1.03 -0.4 -4.86 3 2 0 46 127.118 0 ↓

Vendor Notes

Note Type Comments Provided By
M.P 135-137 C Indofine
MP 135-137° Matrix Scientific
MP 137 - 139 Enamine Building Blocks
Melting_Point 137-140? Alfa-Aesar
Melting_Point 137-140° Alfa-Aesar
MP 137...139 Enamine Building Blocks
MP 139 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Purity 96% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT, STORED UNDER ARGON Matrix Scientific
Warnings Irritant/Stored under Argon/Store in Freezer Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.