UCSF

ZINC06355433

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 39 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) 3.27 1.05 -44.65 2 9 1 104 530.601 8
Mid Mid (pH 6-8) 2.69 1.4 -51.21 1 9 1 101 530.601 8

Activity (Go SEA)

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