UCSF

ZINC21532567

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 23 Yes

Popular Name: (2S)-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[5,1-b]pyrimidin-4-yl)-N-(3-pyridylmethyl)propanamide (2S)-2-(2-methyl-5-oxo-6,7-dihyd…

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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) -0.78 6.02 -17.25 1 7 0 80 313.361 4 ↓
Lo Low (pH 4.5-6) -0.78 6.46 -51.15 2 7 1 81 314.369 4 ↓

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

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