UCSF

ZINC16735036

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 37 No

Popular Name: (5S)-5-(4-butoxy-3-methoxy-phenyl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-1-(3-methox (5S)-5-(4-butoxy-3-methoxy-pheny…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) 3.23 9.28 -61.61 0 9 -1 107 510.563 12 ↓
Mid Mid (pH 6-8) 3.67 7.67 -31.26 1 9 0 104 511.571 11 ↓
Mid Mid (pH 6-8) 2.64 8.69 -26.13 0 9 0 101 511.571 12 ↓

Activity (Go SEA)

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