UCSF

ZINC07505488

Substance Information

In ZINC since Heavy atoms Benign functionality
May 31st, 2006 24 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) 2.78 -6.72 -22.31 3 6 0 79 385.898 7
Hi High (pH 8-9.5) 2.78 -6.14 -60.31 2 6 -1 81 384.89 7

Activity (Go SEA)

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