UCSF

ZINC38139091

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2010 37 No

Popular Name: methyl methyl

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Download: MOL2 SDF SMILES Flexibase

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) 2.04 8.38 -54.4 2 11 1 127 551.667 8 ↓
Mid Mid (pH 6-8) 2.04 5.96 -18.13 1 11 0 126 550.659 8 ↓

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Rings

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

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