UCSF

ZINC11838801

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2008 30 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) 3.62 -2.98 -22.83 1 7 0 93 448.566 8 ↓
Hi High (pH 8-9.5) 3.62 -2.4 -55.09 0 7 -1 95 447.558 8 ↓

Activity (Go SEA)

Rings

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