UCSF

ZINC01555278

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 20 No

Popular Name: Diethyl benzamidomalonate Diethyl benzamidomalonate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16798-45-1 , 96-86-6

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) 1.59 6.76 -9.86 1 6 0 82 279.292 8 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 61-65? Alfa-Aesar
Melting_Point 61-65° Alfa-Aesar
MP 62 - 64 Enamine Building Blocks
MP 62...64 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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