UCSF

ZINC17777773

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2008 35 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) 4.11 11.25 -15.98 0 7 0 68 476.504 7
Ref Reference (pH 7) 4.11 11.53 -10.42 0 7 0 68 476.504 7

Activity (Go SEA)

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