UCSF

ZINC09045696

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2007 35 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) 4.29 2.14 -80.93 1 9 -1 143 469.429 6
Mid Mid (pH 6-8) 3.71 1.84 -86.56 0 9 -1 140 469.429 7

Activity (Go SEA)

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