UCSF

ZINC67725451

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 24 Yes

Popular Name: N-(2-ethylphenyl)-7-methyl-11-oxo-3,7,10-triazaspiro[5.5]undecane-3-carboxamide N-(2-ethylphenyl)-7-methyl-11-ox…

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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) 2.02 6.24 -51.03 3 6 1 66 331.44 2 ↓
Mid Mid (pH 6-8) 2.02 4.05 -11.2 2 6 0 65 330.432 2 ↓

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

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