UCSF

ZINC61458159

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 11 Yes

Popular Name: N-(cyclobutylmethyl)-N-methyl-azetidin-3-amine N-(cyclobutylmethyl)-N-methyl-az…

Find On: PubMed — Wikipedia — Google

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) 1.02 2.31 -35.86 2 2 1 20 155.265 3 ↓
Hi High (pH 8-9.5) 1.02 0.63 -0.88 1 2 0 15 154.257 3 ↓
Mid Mid (pH 6-8) 1.02 4.59 -110.17 3 2 2 21 156.273 3 ↓
Mid Mid (pH 6-8) 1.02 2.9 -32.56 2 2 1 16 155.265 3 ↓

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Rings

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

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