UCSF

ZINC01385474

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 16 Yes

Popular Name: 2-amino-7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-4-ylamine 2-amino-7-(trifluoromethyl)pyrid…

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CAS Number: 338407-52-6

Other Names:

MFCD00202375

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) 0.92 2.19 -6.27 4 5 0 91 229.165 1 ↓
Mid Mid (pH 6-8) 0.92 -3.15 -28.23 5 5 1 92 230.173 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 220 KeyOrganics

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Rings

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

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