UCSF

ZINC67457904

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 24 Yes

Popular Name: N-(2-dimethylaminoethyl)-5-[(4-methyl-1H-imidazol-5-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin N-(2-dimethylaminoethyl)-5-[(4-m…

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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) -0.40 5.98 -93.26 4 8 2 84 333.44 6 ↓
Hi High (pH 8-9.5) -0.40 4.12 -84.31 4 8 2 85 333.44 6 ↓
Hi High (pH 8-9.5) -0.40 3.73 -46.21 3 8 1 83 332.432 6 ↓
Mid Mid (pH 6-8) -0.40 6.33 -173.09 5 8 3 86 334.448 6 ↓

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

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