UCSF

ZINC17987564

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 22 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) 2.25 9.07 -10.86 0 5 0 64 301.342 3
Ref Reference (pH 7) 2.25 9.12 -12.4 0 5 0 64 301.342 3

Activity (Go SEA)

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