UCSF

ZINC24988098

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 26 Yes

Popular Name: 2-[[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]methyl]-7-methyl-[1,3,4]thiadiazolo[2,3-b]pyrimidin-5 2-[[[(1S)-1-(4-imidazol-1-ylphen…

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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) 1.25 9.6 -68.28 2 7 1 82 367.458 5 ↓
Mid Mid (pH 6-8) 1.25 8.32 -20.95 1 7 0 77 366.45 5 ↓
Lo Low (pH 4.5-6) 1.25 10.09 -105.41 3 7 2 83 368.466 5 ↓
Lo Low (pH 4.5-6) 1.25 8.89 -44.17 2 7 1 78 367.458 5 ↓

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

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