UCSF

ZINC67540297

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 27 Yes

Popular Name: 5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-(2-pyridylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine- 5-[(3,5-dimethyl-1H-pyrazol-4-yl…

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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) 0.10 4.91 -59.72 3 8 1 93 366.449 5 ↓
Hi High (pH 8-9.5) 0.10 2.67 -16.6 2 8 0 92 365.441 5 ↓
Lo Low (pH 4.5-6) 0.10 5.31 -97.34 4 8 2 94 367.457 5 ↓

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

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