UCSF

ZINC12216305

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2008 21 No

Popular Name: (2-hydroxy-5-nitro-3-pyridyl)-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)methanone (2-hydroxy-5-nitro-3-pyridyl)-(9…

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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) 0.65 4.86 -23.8 1 7 0 99 305.315 2 ↓
Mid Mid (pH 6-8) 1.11 3.8 -42.16 0 7 -1 102 304.307 2 ↓

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

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