UCSF

ZINC38483168

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2010 21 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) 0.26 0.06 -7 2 6 0 71 311.407 6
Lo Low (pH 4.5-6) 0.26 2.4 -38.39 3 6 1 72 312.415 6

Activity (Go SEA)

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