UCSF

ZINC58503141

Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2011 33 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 6.89 13.04 -51.51 2 4 1 43 454.675 12
Hi High (pH 8-9.5) 6.89 10.83 -8.58 1 4 0 42 453.667 12

Activity (Go SEA)

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