UCSF

ZINC19927032

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 30 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 2.02 7.11 -46.58 4 11 1 142 428.502 7
Hi High (pH 8-9.5) 2.02 4.6 -18.03 3 11 0 140 427.494 7

Activity (Go SEA)

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