UCSF

ZINC62993070

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 36 No

Popular Name: (2E)-2-[[4-(diethylamino)phenyl]methylene]-8-[2-(4-fluorophenyl)ethyl]-4-methyl-7,9-dihydrofuro[2,3- (2E)-2-[[4-(diethylamino)phenyl]…

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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) 6.05 13.36 -44.94 1 5 0 47 487.595 7 ↓
Mid Mid (pH 6-8) 6.05 13.24 -10.8 0 5 0 46 486.587 7 ↓
Lo Low (pH 4.5-6) 6.05 16.21 -95.69 2 5 0 48 488.603 7 ↓

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

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