UCSF

ZINC24890795

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 23 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) 0.25 3.66 -24.34 1 6 0 66 332.429 3
Lo Low (pH 4.5-6) 0.25 5.99 -70.44 2 6 1 67 333.437 3

Activity (Go SEA)

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