UCSF

ZINC41314538

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 25 Yes

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) 2.45 6.65 -15.11 1 7 0 94 376.463 5 ↓
Hi High (pH 8-9.5) 2.52 5.15 -48.77 0 7 -1 100 375.455 5 ↓

Activity (Go SEA)

Rings

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