UCSF

ZINC58322970

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 25 Yes

Popular Name: 2-(1-methylindol-3-yl)-N-[5-(2-pyridyl)-4H-1,2,4-triazol-3-yl]acetamide 2-(1-methylindol-3-yl)-N-[5-(2-p…

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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) 2.06 9.15 -14.63 2 7 0 92 332.367 3 ↓
Mid Mid (pH 6-8) 2.07 8.38 -58.55 1 7 -1 95 331.359 4 ↓

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

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