UCSF

ZINC08964627

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2007 34 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.76 8.66 -50.91 2 8 1 90 469.558 10
Mid Mid (pH 6-8) 2.17 9.34 -59 1 8 1 87 469.558 10

Activity (Go SEA)

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