UCSF

ZINC54427596

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2010 24 No

Popular Name: 1-[[(4-fluorophenyl)methyl-methyl-amino]methyl]-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-t 1-[[(4-fluorophenyl)methyl-methy…

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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) 2.51 13.3 -67.42 1 5 1 40 346.455 4 ↓
Mid Mid (pH 6-8) 2.51 11.5 -28.92 0 5 0 38 345.447 4 ↓

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

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