UCSF

ZINC33822126

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2009 20 Yes

Other Names:

17-octadecenoic acid

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) 7.55 14.33 -43.34 0 2 -1 40 281.46 16
Lo Low (pH 4.5-6) 7.55 12.35 -5.17 1 2 0 37 282.468 16

Activity (Go SEA)

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