UCSF

ZINC18128809

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 30 No

Popular Name: (4Z,5S)-1-(2-dimethylaminoethyl)-4-[hydroxy-(4-methoxy-2-methyl-phenyl)methylene]-5-(4-hydroxyphenyl (4Z,5S)-1-(2-dimethylaminoethyl)…

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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) 2.36 7.63 -76.62 2 7 0 94 410.47 7 ↓
Hi High (pH 8-9.5) 2.36 5.09 -63.26 1 7 -1 93 409.462 7 ↓
Mid Mid (pH 6-8) 1.78 7.45 -61.08 2 7 1 88 411.478 7 ↓

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