UCSF

ZINC20219353

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 31 No

Popular Name: (5S)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-(3-dimethylaminopropyl)-3-hydroxy-5-(4-pyridyl)-5 (5S)-4-(2,3-dihydro-1,4-benzodio…

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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) 0.90 8.01 -80.49 1 8 0 96 423.469 7 ↓
Lo Low (pH 4.5-6) 0.90 7.19 -58.95 2 8 1 93 424.477 7 ↓

Activity (Go SEA)

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