UCSF

ZINC12032114

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.54 1.08 -22.32 0 4 0 42 322.339 2

Activity (Go SEA)

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