UCSF

ZINC49235636

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2010 17 Yes

Popular Name: 1-[2-[[(1S)-2-imidazol-1-yl-1-methyl-ethyl]amino]ethyl]imidazolidin-2-one 1-[2-[[(1S)-2-imidazol-1-yl-1-me…

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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) -0.70 4.1 -54.31 3 6 1 67 238.315 6 ↓
Hi High (pH 8-9.5) -0.70 2.86 -16.43 2 6 0 62 237.307 6 ↓
Lo Low (pH 4.5-6) -0.70 4.61 -105.87 4 6 2 68 239.323 6 ↓

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

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