UCSF

ZINC52481119

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: (2R)-N1-cyclopropyl-N2-methyl-N2-tetrahydropyran-4-yl-butane-1,2-diamine (2R)-N1-cyclopropyl-N2-methyl-N2…

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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) 1.73 4.24 -34.14 2 3 1 29 227.372 6 ↓
Mid Mid (pH 6-8) 1.73 5.83 -113.03 3 3 2 30 228.38 6 ↓

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

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