UCSF

ZINC35713192

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 35 Yes

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) 5.61 15.3 -12.83 2 5 0 61 473.661 9
Lo Low (pH 4.5-6) 5.61 15 -36.25 3 5 1 63 474.669 9

Activity (Go SEA)

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