UCSF

ZINC58332298

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 0.48 9.04 -26.85 0 7 0 64 360.458 7
Lo Low (pH 4.5-6) 0.48 9.8 -39.55 1 7 0 65 361.466 7

Activity (Go SEA)

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