UCSF

ZINC03634816

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 24 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) 5.41 12.75 -42.42 1 2 1 14 324.488 7
Hi High (pH 8-9.5) 5.41 10.2 -4.01 0 2 0 12 323.48 7

Activity (Go SEA)

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