UCSF

ZINC09291928

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 31 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) 2.04 8.24 -56.01 2 7 1 84 487.374 7
Mid Mid (pH 6-8) 1.46 -2.3 -67.84 1 7 1 81 487.374 7

Activity (Go SEA)

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