UCSF

ZINC60022252

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 49 No

Popular Name: 2-[4-(2-phenylethynyl)phenyl]-N,N-bis[2-[4-(2-phenylethynyl)phenyl]ethyl]ethanamine 2-[4-(2-phenylethynyl)phenyl]-N,…

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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) 9.11 31.69 -67.22 1 1 1 4 630.855 9 ↓
Hi High (pH 8-9.5) 9.11 29.59 -14.07 0 1 0 3 629.847 9 ↓

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

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