UCSF

ZINC41585801

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 37 Yes

Popular Name: 7-hydroxy-8-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-3-phenyl-2-(trifluoromethyl)chromen-4-one 7-hydroxy-8-[[4-(4-methoxyphenyl…

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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) 6.02 9.6 -10.72 1 6 0 66 510.512 6 ↓
Hi High (pH 8-9.5) 6.02 10.17 -38.95 0 6 -1 69 509.504 6 ↓
Mid Mid (pH 6-8) 6.02 11.82 -50.67 2 6 1 67 511.52 6 ↓

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

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