UCSF

ZINC43426750

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 12 Yes

Popular Name: 2-[(4aR,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]ethanol 2-[(4aR,7aR)-3,4a,5,6,7,7a-hexah…

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) 0.44 -0.56 -4.44 1 3 0 33 171.24 2 ↓
Mid Mid (pH 6-8) 0.44 1.67 -30.74 2 3 1 34 172.248 2 ↓

Activity (Go SEA)

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