UCSF

ZINC52826362

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 23 Yes

Popular Name: 2-[cyclopentyl-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]amino]acetamide 2-[cyclopentyl-[(9-methyl-4-oxo-…

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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) 1.63 6.53 -44.9 3 6 1 82 315.397 5 ↓
Hi High (pH 8-9.5) 1.63 4.07 -15.24 2 6 0 81 314.389 5 ↓
Mid Mid (pH 6-8) 1.63 4.79 -38.61 3 6 1 82 315.397 5 ↓

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

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