UCSF

ZINC69808045

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 21 Yes

Popular Name: (6R)-N-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6 (6R)-N-[(4-methoxy-3,5-dimethyl-…

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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) 1.08 6.1 -53.21 2 6 1 69 288.375 4 ↓
Mid Mid (pH 6-8) 1.08 4.94 -9.97 1 6 0 65 287.367 4 ↓
Mid Mid (pH 6-8) 1.08 5.47 -39.25 2 6 1 66 288.375 4 ↓

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

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