UCSF

ZINC58357107

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 23 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) 3.22 4.07 -134.3 0 7 -2 114 347.377 4
Lo Low (pH 4.5-6) 3.22 4.05 -51.11 1 7 -1 112 348.385 4

Activity (Go SEA)

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