UCSF

ZINC44699882

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2010 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) -1.41 2.65 -246.05 2 14 -3 215 479.213 8
Mid Mid (pH 6-8) -1.41 1.49 -131.17 3 14 -2 213 480.221 8

Activity (Go SEA)

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