UCSF

ZINC61448697

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 19 Yes

Popular Name: 2-[1-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylmethyl)cyclopentyl]acetic 2-[1-([1,2,4]triazolo[4,3-a]pyri…

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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) 1.13 10.01 -46.91 0 6 -1 83 259.289 4 ↓
Lo Low (pH 4.5-6) 1.13 8.02 -17.42 1 6 0 80 260.297 4 ↓

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

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