UCSF

ZINC22770007

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 19 No

Popular Name: 2-[(E)-[1,2,4]triazolo[4,5-a]pyridin-3-ylmethyliminomethyl]phenol 2-[(E)-[1,2,4]triazolo[4,5-a]pyr…

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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) 2.04 6.56 -19.14 2 5 0 64 253.285 3 ↓
Hi High (pH 8-9.5) 2.04 5.29 -50.27 0 5 -1 66 251.269 3 ↓
Mid Mid (pH 6-8) 2.04 4.43 -17.76 1 5 0 63 252.277 3 ↓

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

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