UCSF

ZINC00320258

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 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) 4.38 0.25 -6.03 1 3 0 29 265.788 3
Mid Mid (pH 6-8) 4.38 0.43 -23.96 2 3 1 30 266.796 3

Activity (Go SEA)

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