UCSF

ZINC33736625

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 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) 1.23 3.78 -17.89 3 8 0 117 379.42 4
Mid Mid (pH 6-8) 1.23 4.41 -17.21 3 8 0 117 379.42 4

Activity (Go SEA)

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