UCSF

ZINC62670042

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 5th, 2011 17 Yes

Popular Name: 3-piperazin-1-yl-4,5,6,7,8,9-hexahydro-2H-cycloocta[c]pyrazole 3-piperazin-1-yl-4,5,6,7,8,9-hex…

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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) 2.03 5.21 -39.72 3 4 1 49 235.355 1 ↓
Hi High (pH 8-9.5) 2.03 3.9 -5.27 2 4 0 44 234.347 1 ↓

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

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