UCSF

ZINC06143957

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2006 31 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) 2.40 1.66 -59.89 2 9 1 117 426.449 8
Mid Mid (pH 6-8) 1.82 1.5 -68.76 1 9 1 113 426.449 8

Activity (Go SEA)

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