UCSF

ZINC40872327

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2010 26 No

Popular Name: 3-(2,4-dichloro-5-fluoro-phenyl)-N-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ami 3-(2,4-dichloro-5-fluoro-phenyl)…

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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) 5.28 10.63 -8.85 1 5 0 55 412.252 2 ↓
Lo Low (pH 4.5-6) 5.28 11.51 -47.39 2 5 1 57 413.26 2 ↓

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

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