UCSF

ZINC69484756

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 23 Yes

Popular Name: 1-(4-acetylpiperazin-1-yl)-2-(3-azaspiro[5.5]undecan-3-yl)ethanone 1-(4-acetylpiperazin-1-yl)-2-(3-…

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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) 1.34 8.35 -46.2 1 5 1 45 322.473 2 ↓
Hi High (pH 8-9.5) 1.34 6.22 -11.45 0 5 0 44 321.465 2 ↓

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

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