UCSF

ZINC48984892

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 26 Yes

Popular Name: N-[5-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-[methyl(methylsulfonyl)amin N-[5-(imidazo[1,2-a]pyridin-2-yl…

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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) 1.52 4.85 -35.46 1 9 0 110 412.522 7 ↓
Hi High (pH 8-9.5) 1.34 3.27 -65.53 0 9 -1 116 411.514 7 ↓
Lo Low (pH 4.5-6) 1.52 5.29 -52.79 2 9 1 111 413.53 7 ↓

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

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