UCSF

ZINC06361959

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2006 24 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) 1.09 2.65 -54.21 2 8 -1 107 366.448 8
Lo Low (pH 4.5-6) 1.09 3.07 -19.58 3 8 0 105 367.456 8

Activity (Go SEA)

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