UCSF

ZINC32251384

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 16 Yes

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) 2.03 3.17 -15.57 1 4 0 64 216.192 0
Hi High (pH 8-9.5) 2.03 3.94 -47.76 0 4 -1 66 215.184 0

Activity (Go SEA)

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