UCSF

ZINC53438191

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 20 Yes

Popular Name: N'-benzyl-N-[(2-fluorophenyl)methyl]-N-methyl-ethane-1,2-diamine N'-benzyl-N-[(2-fluorophenyl)met…

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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) 3.04 7.71 -41.89 2 2 1 20 273.375 7 ↓
Lo Low (pH 4.5-6) 3.04 10.03 -120.68 3 2 2 21 274.383 7 ↓

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

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