UCSF

ZINC15990015

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2008 34 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) 3.07 13.22 -19.22 0 7 0 88 452.466 4
Lo Low (pH 4.5-6) 3.07 13.23 -53.05 1 7 0 89 453.474 4

Activity (Go SEA)

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