UCSF

ZINC54931402

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 9 Yes

Popular Name: N-cyclopropyl-N-methyl-azetidin-3-amine N-cyclopropyl-N-methyl-azetidin-…

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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) 0.34 1.18 -35.51 2 2 1 20 127.211 2 ↓
Hi High (pH 8-9.5) 0.34 -0.5 -1.15 1 2 0 15 126.203 2 ↓
Mid Mid (pH 6-8) 0.34 1.72 -29.88 2 2 1 16 127.211 2 ↓
Mid Mid (pH 6-8) 0.34 3.4 -103.8 3 2 2 21 128.219 2 ↓

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Rings

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

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