UCSF

ZINC62026860

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 27 Yes

Popular Name: 2-[4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperazin-1-yl]pyridine-3-carbonitrile 2-[4-[(2-oxo-3H-1,3-benzoxazol-6…

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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) 0.86 3.91 -18.81 1 9 0 123 385.405 3 ↓
Hi High (pH 8-9.5) 1.32 1.28 -52.14 0 9 -1 126 384.397 3 ↓

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

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