UCSF

ZINC06389011

Substance Information

In ZINC since Heavy atoms Benign functionality
March 26th, 2006 28 No

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) 3.27 10.83 -16.79 1 5 0 47 393.512 9
Lo Low (pH 4.5-6) 3.27 11.3 -53.18 2 5 1 48 394.52 9

Activity (Go SEA)

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