UCSF

ZINC49538514

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 16 Yes

Popular Name: 2-hydroxy-5-methyl-4-oxo-3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylic acid 2-hydroxy-5-methyl-4-oxo-3H,4H-p…

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CAS Number: 1245569-58-7

Download: MOL2 SDF SMILES Flexibase

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) 0.59 -0.71 -98.27 1 7 -2 122 219.156 1 ↓
Mid Mid (pH 6-8) 0.14 1.24 -42.64 2 7 -1 119 220.164 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 266 - 268 Enamine Building Blocks
MP 266...268 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Rings

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

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