UCSF

ZINC09159599

Substance Information

In ZINC since Heavy atoms Benign functionality
August 10th, 2007 32 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) 3.96 11.34 -48.11 2 6 1 71 437.56 10
Mid Mid (pH 6-8) 3.37 11.98 -59.4 1 6 1 68 437.56 10

Activity (Go SEA)

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