UCSF

ZINC29223489

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2009 22 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) -2.13 6.47 -40.06 1 4 1 32 328.408 5
Mid Mid (pH 6-8) -2.13 9 -113.56 2 4 2 34 329.416 5

Activity (Go SEA)

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