UCSF

ZINC62993072

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 39 No

Popular Name: (2E)-2-[[4-(diethylamino)phenyl]methylene]-8-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-7,9-dihydrofuro (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) 5.53 12.48 -48.3 1 7 0 66 529.657 9 ↓
Mid Mid (pH 6-8) 5.53 12.37 -13.88 0 7 0 64 528.649 9 ↓
Lo Low (pH 4.5-6) 5.53 15.34 -97.75 2 7 0 67 530.665 9 ↓

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

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