UCSF

ZINC32658945

Substance Information

In ZINC since Heavy atoms Benign functionality
May 7th, 2009 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 1.23 6.19 -25.99 2 7 0 104 307.313 2
Lo Low (pH 4.5-6) 1.69 3.96 -23.4 2 7 0 104 307.313 2

Activity (Go SEA)

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