UCSF

ZINC17097953

Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2008 31 No

Other Names:

MFCD02954515

Download: MOL2 SDF SMILES Flexibase

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) 6.67 15.24 -57.75 0 6 -1 88 431.493 6
Ref Reference (pH 7) 6.67 14.58 -58.08 0 6 -1 88 431.493 6

Activity (Go SEA)

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