UCSF

ZINC69563781

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 21 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) 0.20 4.05 -17.45 2 7 0 100 328.419 7 ↓
Lo Low (pH 4.5-6) 0.20 4.38 -53.27 3 7 1 101 329.427 7 ↓

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Rings

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

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