UCSF

ZINC12038706

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2008 29 Yes

Popular Name: N-[1-[2-[[(1S)-isochroman-1-yl]methylamino]-2-oxo-ethyl]pyrazol-4-yl]pyridine-2-carboxamide N-[1-[2-[[(1S)-isochroman-1-yl]m…

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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) 0.70 -3.58 -23.5 2 8 0 98 391.431 6 ↓

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