UCSF

ZINC71554825

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 29 Yes

Popular Name: ethyl ethyl

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Annotations

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Vendors

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) 2.85 11.61 -50.32 2 7 1 77 413.523 6 ↓
Mid Mid (pH 6-8) 2.85 11.9 -81.04 3 7 2 78 414.531 6 ↓
Mid Mid (pH 6-8) 2.85 9.19 -18.38 1 7 0 76 412.515 6 ↓

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

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