UCSF

ZINC59475025

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2011 21 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) 3.80 11.32 -14.04 0 5 0 64 281.315 3
Lo Low (pH 4.5-6) 3.80 11.8 -27.67 1 5 1 65 282.323 3

Activity (Go SEA)

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