UCSF

ZINC49573416

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 21 Yes

Popular Name: ethyl ethyl

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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) 2.58 9.92 -40.24 1 5 1 48 308.789 7 ↓
Mid Mid (pH 6-8) 2.58 9.12 -29.01 1 5 1 48 308.789 7 ↓
Mid Mid (pH 6-8) 2.58 8.35 -12.76 0 5 0 47 307.781 7 ↓

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

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