UCSF

ZINC52515649

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 16 Yes

Popular Name: (2S)-N,N'-dicyclopropyl-N'-isobutyl-2-methyl-propane-1,3-diamine (2S)-N,N'-dicyclopropyl-N'-isobu…

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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) 2.73 9.2 -95.08 3 2 2 21 226.408 8 ↓
Mid Mid (pH 6-8) 2.73 6.96 -34.77 2 2 1 20 225.4 8 ↓

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

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