UCSF

ZINC00389577

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 10 Yes

Popular Name: (3-Amino-4-methylphenyl)methanol (3-Amino-4-methylphenyl)methanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 50868-72-9 , 81863-45-8 , [81863-45-8]

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 0.46 -5.31 3 2 0 46 137.182 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 108 - 110 Enamine Building Blocks
MP 108...110 Enamine Building Blocks
Melting_Point 43-46? Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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

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