UCSF

ZINC52372873

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2010 18 Yes

Popular Name: (2R)-N1-cyclopropyl-N2-[(3-methoxyphenyl)methyl]-N2-methyl-propane-1,2-diamine (2R)-N1-cyclopropyl-N2-[(3-metho…

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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) 2.25 7.77 -113.23 3 3 2 30 250.386 7 ↓
Hi High (pH 8-9.5) 2.25 5.84 -33.86 2 3 1 29 249.378 7 ↓

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

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