UCSF

ZINC03640461

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 26 Yes

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) 4.89 11.32 -47.52 1 4 1 26 375.92 8
Mid Mid (pH 6-8) 4.89 9.12 -6.53 0 4 0 25 374.912 8

Activity (Go SEA)

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