UCSF

ZINC06165872

Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2006 35 No

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) 2.05 -3.09 -53.72 2 9 1 108 502.613 10
Mid Mid (pH 6-8) 1.47 -3.2 -63.57 1 9 1 105 502.613 10

Activity (Go SEA)

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