UCSF

ZINC32026431

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 18 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) -1.64 2.26 -66.59 3 6 0 94 260.334 9
Hi High (pH 8-9.5) -1.64 -0.06 -57.12 2 6 -1 93 259.326 9

Activity (Go SEA)

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