UCSF

ZINC43172629

Substance Information

In ZINC since Heavy atoms Benign functionality
May 8th, 2010 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.76 8.88 -12.25 1 5 0 51 360.841 3

Activity (Go SEA)

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