UCSF

ZINC22758381

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 24 No

Popular Name: 1-butyl-3-[[[(1S)-indan-1-yl]-methyl-amino]methyl]imidazolidine-2,4,5-trione 1-butyl-3-[[[(1S)-indan-1-yl]-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) 1.87 7.32 -5.96 0 6 0 64 329.4 6 ↓
Lo Low (pH 4.5-6) 1.87 9.85 -39.58 1 6 1 66 330.408 6 ↓

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

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