UCSF

ZINC62669794

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 5th, 2011 16 Yes

Popular Name: N-(2-methoxyethyl)-4,5,6,7,8,9-hexahydro-2H-cycloocta[c]pyrazol-3-amine N-(2-methoxyethyl)-4,5,6,7,8,9-h…

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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) 2.47 3.92 -5.58 2 4 0 50 223.32 4 ↓
Lo Low (pH 4.5-6) 2.47 4.04 -26.25 3 4 1 51 224.328 4 ↓

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

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