UCSF

ZINC11816479

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2008 29 Yes

Popular Name: 5-[(benzyl-methyl-amino)methyl]-N-[[(1S)-isochroman-1-yl]methyl]isoxazole-3-carboxamide 5-[(benzyl-methyl-amino)methyl]-…

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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) 2.85 -0.2 -50.49 2 6 1 69 392.479 7 ↓

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