UCSF

ZINC07607482

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 23 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) 0.74 4.12 -55.26 2 7 1 72 322.385 6
Hi High (pH 8-9.5) 0.74 1.93 -22.78 1 7 0 71 321.377 6

Activity (Go SEA)

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