UCSF

ZINC36154574

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 23 Yes

Popular Name: methyl methyl

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Download: MOL2 SDF SMILES Flexibase

Annotations

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) 2.76 6.79 -60.21 3 6 1 89 336.437 5 ↓
Hi High (pH 8-9.5) 2.76 5.01 -20.42 2 6 0 84 335.429 5 ↓
Mid Mid (pH 6-8) 3.22 4.38 -43.88 2 6 0 92 335.429 5 ↓

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

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