UCSF

ZINC53639160

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 27 Yes

Popular Name: N-[3-[benzyl(methyl)amino]propyl]-2-(4-cyano-2-methoxy-phenoxy)acetamide N-[3-[benzyl(methyl)amino]propyl…

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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) 2.14 10 -56.73 2 6 1 76 368.457 10 ↓
Hi High (pH 8-9.5) 2.14 7.67 -17.74 1 6 0 75 367.449 10 ↓

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

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