UCSF

ZINC34688036

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.85 7.08 -18.5 3 6 0 105 349.39 7
Hi High (pH 8-9.5) 3.03 5.66 -51.7 2 6 -1 112 348.382 7

Activity (Go SEA)

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