UCSF

ZINC67447380

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 Yes

Popular Name: (2S)-1-[[2-(2,4-dimethoxy-3-methyl-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-methyl-1,4-diazepan-5-one (2S)-1-[[2-(2,4-dimethoxy-3-meth…

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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) 2.40 4.56 -46.51 2 7 1 78 374.461 5 ↓
Hi High (pH 8-9.5) 2.40 2.59 -13.09 1 7 0 77 373.453 5 ↓

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

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