UCSF

ZINC34984846

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 29 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) -1.07 -1.66 -174.47 13 9 3 184 417.619 19
Hi High (pH 8-9.5) -1.07 -1.96 -109.48 12 9 2 183 416.611 19

Activity (Go SEA)

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