UCSF

ZINC53526197

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2010 25 No

Popular Name: (3S)-1-oxo-N-[5-(2-pyridyl)-4H-1,2,4-triazol-3-yl]isochromane-3-carboxamide (3S)-1-oxo-N-[5-(2-pyridyl)-4H-1…

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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) 1.48 6.51 -58.33 1 8 -1 116 334.315 3 ↓

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

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