UCSF

ZINC20756804

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 27 Yes

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) 1.43 5.18 -17.41 1 7 0 71 375.469 8
Mid Mid (pH 6-8) 1.43 7.45 -51.52 2 7 1 72 376.477 8

Activity (Go SEA)

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