UCSF

ZINC09041008

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2007 36 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 5.16 1.1 -24.78 1 8 0 99 505.596 10

Activity (Go SEA)

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