UCSF

ZINC01397929

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 19 Yes

Popular Name: 1-(2,4-dichloro-5-methoxyphenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid 1-(2,4-dichloro-5-methoxyphenyl)…

Find On: PubMed — Wikipedia — Google

CAS Number: 103058-64-6

Other Names:

MFCD00975207

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) 2.19 0.45 -58.35 0 6 -1 80 301.109 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 197 - 198 KeyOrganics

Activity (Go SEA)

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