UCSF

ZINC00700307

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 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) 3.10 11.03 -11.71 0 7 0 70 469.589 5
Lo Low (pH 4.5-6) 3.10 12.66 -43.85 1 7 1 71 470.597 5

Activity (Go SEA)

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