UCSF

ZINC35807874

Substance Information

In ZINC since Heavy atoms Benign functionality
October 13th, 2009 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) 4.88 9.6 -15.38 1 6 0 64 477.63 8
Lo Low (pH 4.5-6) 4.88 11.74 -58.69 2 6 1 65 478.638 8

Activity (Go SEA)

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