UCSF

ZINC24887288

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 27 Yes

Popular Name: methyl methyl

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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) 2.88 6.88 -44.25 2 5 1 49 372.533 6 ↓
Mid Mid (pH 6-8) 2.88 10.59 -92.76 3 5 2 47 373.541 6 ↓
Mid Mid (pH 6-8) 2.88 10.5 -91.77 3 5 2 47 373.541 6 ↓
Lo Low (pH 4.5-6) 2.88 9.22 -109.65 3 5 2 51 373.541 6 ↓
Lo Low (pH 4.5-6) 2.88 11.47 -205.19 4 5 3 52 374.549 6 ↓

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