UCSF

ZINC71602572

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2011 19 Yes

Popular Name: 5-(4-methyl-1-thiazol-2-yl-3,6-dihydro-2H-pyridin-5-yl)pyridin-2-amine 5-(4-methyl-1-thiazol-2-yl-3,6-d…

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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) 2.22 6.72 -32.88 3 4 1 56 273.385 2 ↓
Mid Mid (pH 6-8) 2.22 6.31 -8.81 2 4 0 55 272.377 2 ↓
Lo Low (pH 4.5-6) 2.22 7.17 -72.5 4 4 2 58 274.393 2 ↓

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

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