UCSF

ZINC61448218

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 21 Yes

Popular Name: 2-[1-[(7-methyl-[1,2,4]triazolo[3,4-f]pyrimidin-3-yl)methyl]cyclohexyl]acetic 2-[1-[(7-methyl-[1,2,4]triazolo[…

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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) 1.88 10.01 -58.23 0 6 -1 83 287.343 4 ↓
Lo Low (pH 4.5-6) 1.88 8.04 -10.79 1 6 0 80 288.351 4 ↓

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

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