UCSF

ZINC65164751

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 29 Yes

Popular Name: 3-[2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]ethyl]-1-methyl-pyrrolo[2,3-b]pyridine 3-[2-[4-(2,5-difluorophenyl)sulf…

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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) 2.52 7.51 -14.41 0 6 0 58 420.485 5 ↓
Lo Low (pH 4.5-6) 2.52 9.72 -56.39 1 6 1 60 421.493 5 ↓

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

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