UCSF

ZINC09422090

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 23 No

Popular Name: 8-isopropyl-7,7-dioxo-9-(2-pyridylmethylene)-7$l^{6}-thia-8-azabicyclo[4.4.0]deca-2,4,11-trien-10-on 8-isopropyl-7,7-dioxo-9-(2-pyrid…

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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) 2.37 -2.41 -14.12 0 5 0 67 328.393 2 ↓
Lo Low (pH 4.5-6) 2.37 -2.82 -36.23 1 5 1 68 329.401 2 ↓

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Rings

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

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