UCSF

ZINC20219305

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 38 No

Popular Name: (5S)-5-(4-allyloxyphenyl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-1-(3-morpholinopropy (5S)-5-(4-allyloxyphenyl)-4-(2,3…

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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) 2.73 7.7 -62.18 0 9 -1 101 519.574 10 ↓
Mid Mid (pH 6-8) 2.73 9.96 -81.31 1 9 0 102 520.582 10 ↓
Lo Low (pH 4.5-6) 2.73 9.22 -58.91 2 9 1 99 521.59 10 ↓

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