UCSF

ZINC15498584

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2008 30 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) 3.24 4.69 -18.34 4 7 0 118 423.494 6
Hi High (pH 8-9.5) 3.24 4.77 -45.87 3 7 -1 120 422.486 6

Activity (Go SEA)

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