UCSF

ZINC24080911

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2009 31 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) 4.03 11.7 -69.01 1 6 0 74 487.394 8
Hi High (pH 8-9.5) 4.03 9.17 -54.62 0 6 -1 73 486.386 8

Activity (Go SEA)

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