UCSF

ZINC69487161

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 23 Yes

Popular Name: 2-[(1R)-1-(2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)ethyl]-5-(2-thienyl)-1,3,4-oxadiazole 2-[(1R)-1-(2-methyl-6,8-dihydro-…

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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) 1.33 1.69 -14.99 0 6 0 68 327.413 3 ↓
Lo Low (pH 4.5-6) 1.33 3.94 -46.92 1 6 1 69 328.421 3 ↓

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

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