UCSF

ZINC41514738

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 33 Yes

Popular Name: ethyl ethyl

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Annotations

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Vendors

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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) 5.26 11.42 -45.52 2 7 1 86 447.511 10 ↓
Hi High (pH 8-9.5) 5.26 9.85 -46.03 0 7 -1 88 445.495 10 ↓
Hi High (pH 8-9.5) 5.26 12.19 -28.07 1 7 0 89 446.503 10 ↓
Mid Mid (pH 6-8) 5.26 9.09 -13.25 1 7 0 85 446.503 10 ↓

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