UCSF

ZINC33819078

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 37 No

Popular Name: (2R)-2-[[4-[4-[(6-chlorobenzofuran-2-yl)methyl]piperazin-1-yl]phenoxy]methyl]-2-methyl-6-nitro-3H-im (2R)-2-[[4-[4-[(6-chlorobenzofur…

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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) 5.04 14.19 -91.64 2 10 2 104 525.993 7 ↓
Hi High (pH 8-9.5) 5.04 10.85 -22.87 0 10 0 102 523.977 7 ↓
Mid Mid (pH 6-8) 5.04 13.09 -63.73 1 10 1 103 524.985 7 ↓
Mid Mid (pH 6-8) 5.04 11.95 -42 1 10 1 103 524.985 7 ↓

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

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