UCSF

ZINC08384546

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 33 No

Other Names:

MFCD03501532

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) 1.43 -0.37 -58.79 2 9 1 102 457.503 9
Mid Mid (pH 6-8) 0.84 -0.55 -67.18 1 9 1 99 457.503 9

Activity (Go SEA)

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