UCSF

ZINC43211931

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 35 No

Popular Name: (1R,3R,3aS,6aS)-5-cyclohexyl-1-(9H-fluoren-2-yl)-3-isopropyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3 (1R,3R,3aS,6aS)-5-cyclohexyl-1-(…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.04 14.67 -37.88 2 6 0 94 472.585 4 ↓
Hi High (pH 8-9.5) 3.04 13.69 -47.03 1 6 -1 90 471.577 4 ↓

Activity (Go SEA)

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