UCSF

ZINC67245735

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 22 No

Popular Name: 4,4-dioxo-1-(p-tolyl)pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide 4,4-dioxo-1-(p-tolyl)pyrido[2,3-…

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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) 1.04 1.31 -16.91 2 7 0 106 316.342 2 ↓
Hi High (pH 8-9.5) 1.35 -0.19 -60.04 1 7 -1 110 315.334 2 ↓
Lo Low (pH 4.5-6) 1.04 1.61 -46.24 3 7 1 107 317.35 2 ↓

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

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