UCSF

ZINC35454535

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 26 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) -1.11 0.76 -56.26 4 8 1 107 361.422 4
Hi High (pH 8-9.5) -1.11 0.44 -17.67 3 8 0 105 360.414 4

Activity (Go SEA)

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