UCSF

ZINC32076308

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 22 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) -1.61 3.3 -80.76 4 7 0 117 313.398 8
Hi High (pH 8-9.5) -1.61 0.95 -63.74 3 7 -1 116 312.39 8

Activity (Go SEA)

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