UCSF

ZINC66122770

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 33 No

Popular Name: (E)-3-[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]-N-[(E)-2H-phthalazin-1-ylideneamino]prop-2-enami (E)-3-[4-[(2E)-3,7-dimethylocta-…

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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) 6.31 13.62 -13.32 2 6 0 76 442.563 10 ↓
Mid Mid (pH 6-8) 6.31 13.77 -38.08 3 6 1 77 443.571 10 ↓

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

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