UCSF

ZINC20745082

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 29 No

Download: MOL2 SDF SMILES Flexibase

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) 1.19 5.13 -19.17 2 9 0 115 413.459 4
Ref Reference (pH 7) 1.01 7.56 -18.02 2 9 0 111 413.459 4

Activity (Go SEA)

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