UCSF

ZINC00157440

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 Yes

Popular Name: 1-benzylurea 1-benzylurea

Find On: PubMed — Wikipedia — Google

CAS Numbers: 538-32-9 , 76523-24-5 , [538-32-9]

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) 0.77 0.71 -7.94 3 3 0 55 150.181 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 146-151? Alfa-Aesar
Melting_Point 146-151° Alfa-Aesar
melting_point 148 - 150 KeyOrganics
MP 149 TCI
Mp [°C] 149 - 151 Acros Organics
MP 149...151 Enamine Building Blocks
Melting_Point 172-175? Alfa-Aesar
Melting_Point 172-175° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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