UCSF

ZINC08438648

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 33 No

Other Names:

MFCD05884256

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) 1.95 0.83 -55.72 2 9 1 110 455.487 9
Mid Mid (pH 6-8) 1.37 0.67 -64.29 1 9 1 107 455.487 9

Activity (Go SEA)

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