UCSF

ZINC27527897

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 30 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) 5.19 9.76 -44.47 0 5 -1 64 460.984 9
Lo Low (pH 4.5-6) 4.73 10.85 -14.53 1 5 0 61 461.992 9

Activity (Go SEA)

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