UCSF

ZINC62977240

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Substance Information

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

Popular Name: (7Z)-3-[(4-chlorophenyl)methyl]-7-[[4-(diethylamino)phenyl]methylene]-9-methyl-2,4-dihydrofuro[3,2-g (7Z)-3-[(4-chlorophenyl)methyl]-…

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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) 6.16 13.18 -46.74 1 5 0 47 490.023 6 ↓
Mid Mid (pH 6-8) 6.16 13.07 -10.58 0 5 0 46 489.015 6 ↓
Lo Low (pH 4.5-6) 6.16 16.07 -111.23 2 5 0 48 491.031 6 ↓

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

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