UCSF

ZINC71554414

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 31 Yes

Popular Name: ethyl ethyl

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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) 2.97 10.72 -52.33 2 8 1 86 443.549 7 ↓
Mid Mid (pH 6-8) 2.97 8.3 -15.27 1 8 0 85 442.541 7 ↓
Lo Low (pH 4.5-6) 2.97 11.16 -78.66 3 8 2 88 444.557 7 ↓

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

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