UCSF

ZINC23333979

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 2008 34 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) 4.49 12.76 -12.67 0 5 0 46 475.658 10
Lo Low (pH 4.5-6) 4.49 15.03 -48.63 1 5 1 47 476.666 10

Activity (Go SEA)

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