UCSF

ZINC08715766

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 33 No

Other Names:

MFCD08728996

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) 1.97 6.17 -51.13 3 8 1 101 453.515 8
Mid Mid (pH 6-8) 1.39 6.88 -60.44 2 8 1 98 453.515 8

Activity (Go SEA)

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