UCSF

ZINC49351353

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 19 Yes

Popular Name: N-[(1R)-4-chloroindan-1-yl]-5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxamide N-[(1R)-4-chloroindan-1-yl]-5-ox…

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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) 0.81 2.39 -9.22 3 6 0 91 278.699 2 ↓
Mid Mid (pH 6-8) 1.27 -0.15 -46.78 2 6 -1 94 277.691 2 ↓
Lo Low (pH 4.5-6) 1.27 0.94 -23.93 3 6 0 95 278.699 2 ↓

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

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