UCSF

ZINC07793007

Substance Information

In ZINC since Heavy atoms Benign functionality
June 20th, 2006 23 No

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) 2.43 7.04 -51.3 3 5 1 63 336.481 9
Mid Mid (pH 6-8) 2.43 4.85 -19.47 2 5 0 61 335.473 9

Activity (Go SEA)

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