UCSF

ZINC62993117

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 35 No

Popular Name: (2Z)-2-[[4-(diethylamino)phenyl]methylene]-8-(3-phenylpropyl)-7,9-dihydrofuro[2,3-f][1,3]benzoxazin- (2Z)-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) 6.02 13.59 -50.91 1 5 0 47 469.605 8 ↓
Mid Mid (pH 6-8) 6.02 13.49 -10.13 0 5 0 46 468.597 8 ↓
Lo Low (pH 4.5-6) 6.02 16.42 -117.58 2 5 0 48 470.613 8 ↓

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

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