UCSF

ZINC41666533

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 32 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) 2.70 7.15 -15.19 0 8 0 81 444.528 9 ↓
Mid Mid (pH 6-8) 2.70 9.43 -50.32 1 8 1 83 445.536 9 ↓
Mid Mid (pH 6-8) 2.70 10.01 -52.59 1 8 1 83 445.536 9 ↓
Lo Low (pH 4.5-6) 2.70 12.3 -124.55 2 8 2 84 446.544 9 ↓

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