UCSF

ZINC00341299

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 No

Popular Name: methyl 2-[(trifluoroacetyl)amino]benzoate methyl 2-[(trifluoroacetyl)amino…

Find On: PubMed — Wikipedia — Google

CAS Number: 31385-12-3

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) 2.35 3.47 -6.43 1 4 0 55 247.172 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 63 - 65 KeyOrganics

Activity (Go SEA)

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