UCSF

ZINC08901106

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 32 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) 4.27 11.76 -49.65 2 6 1 71 435.544 9
Mid Mid (pH 6-8) 3.25 12.39 -45.63 1 6 1 68 435.544 10

Activity (Go SEA)

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