UCSF

ZINC07360688

Substance Information

In ZINC since Heavy atoms Benign functionality
May 26th, 2006 28 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) 3.46 9.64 -45.13 2 6 1 63 382.484 7
Hi High (pH 8-9.5) 3.46 7.69 -16.43 1 6 0 62 381.476 7

Activity (Go SEA)

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