UCSF

ZINC34468911

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 23 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) -2.57 -2.52 -55.36 4 10 -1 158 334.301 7
Lo Low (pH 4.5-6) -2.57 -4.61 -16.67 5 10 0 155 335.309 7

Activity (Go SEA)

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