UCSF

ZINC15936860

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 27 No

Popular Name: N-(5-methyl-7-oxo-2-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-4-nitro-benzenesulfonamide N-(5-methyl-7-oxo-2-propyl-1H-[1…

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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) 2.00 7.7 -120.02 0 11 -2 160 390.381 6 ↓
Mid Mid (pH 6-8) 1.54 8.74 -52.7 1 11 -1 157 391.389 6 ↓
Lo Low (pH 4.5-6) 2.00 7.02 -43.24 1 11 -1 158 391.389 6 ↓

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

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