UCSF

ZINC07775643

Substance Information

In ZINC since Heavy atoms Benign functionality
June 16th, 2006 24 Yes

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) 2.31 4.82 -14.47 3 6 0 87 320.352 4
Mid Mid (pH 6-8) 2.31 4.75 -13.13 3 6 0 87 320.352 4

Activity (Go SEA)

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