UCSF

ZINC71589409

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2011 25 Yes

Popular Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-1-(2-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)piperidi N-[(1R)-2-methoxy-1-methyl-ethyl…

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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) 0.50 5.25 -56.85 3 7 1 84 348.471 5 ↓
Hi High (pH 8-9.5) 0.50 3.89 -12.43 2 7 0 79 347.463 5 ↓
Lo Low (pH 4.5-6) 0.50 5.64 -117.72 4 7 2 85 349.479 5 ↓

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

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