UCSF

ZINC08892956

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2007 33 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) 3.61 10.16 -59.28 2 7 1 81 494.395 9
Mid Mid (pH 6-8) 3.03 10.87 -69.17 1 7 1 77 494.395 9

Activity (Go SEA)

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