UCSF

ZINC34038659

Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2009 36 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) 0.58 3.12 -57.81 6 10 -1 184 499.54 3
Mid Mid (pH 6-8) 0.58 4.09 -54.51 7 10 0 186 500.548 3

Activity (Go SEA)

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