UCSF

ZINC01152991

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 29 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) 4.72 12.82 -17.97 0 5 0 64 454.32 5
Ref Reference (pH 7) 4.72 12.87 -17.89 0 5 0 64 454.32 5
Ref Reference (pH 7) 4.72 12.85 -16.81 0 5 0 64 454.32 5

Activity (Go SEA)

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