UCSF

ZINC41585378

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 33 No

Popular Name: (2Z)-7-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-6-hydroxy-4-methyl-2-(3-pyridylmethylene)benzofura (2Z)-7-[[4-(2-fluorophenyl)piper…

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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) 3.77 11.19 -46.53 2 6 1 71 446.502 4 ↓
Mid Mid (pH 6-8) 3.77 9.55 -46.33 0 6 -1 73 444.486 4 ↓
Mid Mid (pH 6-8) 3.77 11.76 -32.23 1 6 0 74 445.494 4 ↓
Mid Mid (pH 6-8) 3.77 8.95 -10.24 1 6 0 70 445.494 4 ↓

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

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