UCSF

ZINC65537985

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 26 No

Popular Name: cyclohexyl-[4-[2-(4-nitrophenoxy)ethyl]piperazin-1-yl]methanone cyclohexyl-[4-[2-(4-nitrophenoxy…

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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) 3.48 8.5 -13.45 0 7 0 79 361.442 6 ↓
Lo Low (pH 4.5-6) 3.48 10.76 -60.15 1 7 1 80 362.45 6 ↓

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

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