UCSF

ZINC49553695

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 28 Yes

Popular Name: [4-(4-methoxyphenyl)piperazin-1-yl]methylBLAHone [4-(4-methoxyphenyl)piperazin-1-…

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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) 2.96 9.62 -61.92 2 6 1 63 397.524 4 ↓
Mid Mid (pH 6-8) 2.96 7.57 -14.24 1 6 0 61 396.516 4 ↓
Mid Mid (pH 6-8) 2.96 9.76 -58.4 2 6 1 63 397.524 4 ↓

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Rings

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

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