UCSF

ZINC08742619

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 30 No

Other Names:

MFCD03011267

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) 3.99 0.64 -51.19 2 6 1 71 474.375 7
Mid Mid (pH 6-8) 2.96 0.49 -47.35 1 6 1 68 474.375 8

Activity (Go SEA)

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