UCSF

ZINC32126797

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 Yes

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) 1.43 3.21 -51.29 4 5 1 75 281.376 7
Hi High (pH 8-9.5) 1.43 2.9 -12.16 3 5 0 74 280.368 7

Activity (Go SEA)

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