UCSF

ZINC50664794

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2010 32 Yes

Popular Name: 4-[4-(1H-benzimidazol-2-yl)piperazin-1-yl]butylBLAHone 4-[4-(1H-benzimidazol-2-yl)piper…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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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) 4.23 14.12 -100 4 6 2 67 431.584 6 ↓
Hi High (pH 8-9.5) 4.23 11.5 -13.73 2 6 0 64 429.568 6 ↓
Mid Mid (pH 6-8) 4.23 11.92 -30.45 3 6 1 66 430.576 6 ↓

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

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