UCSF

ZINC71589105

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2011 19 Yes

Popular Name: (2R)-4-(4-ethylphenyl)-2-piperazin-1-yl-butan-1-ol (2R)-4-(4-ethylphenyl)-2-piperaz…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 2.23 4.57 -38.76 3 3 1 40 263.405 6 ↓
Hi High (pH 8-9.5) 2.23 3.22 -3.64 2 3 0 35 262.397 6 ↓

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

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