UCSF

ZINC03678240

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 14 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) 0.00 5.07 -35.52 3 3 0 68 213.664 3
Hi High (pH 8-9.5) 0.00 4.73 -40.96 2 3 -1 66 212.656 3

Activity (Go SEA)

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