UCSF

ZINC20254499

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 17 Yes

Other Names:

MFCD10037438

MFCD24387798

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) -0.42 -0.72 -54.28 4 6 1 91 259.355 3
Hi High (pH 8-9.5) -0.42 -1.08 -55.4 3 6 0 94 258.347 3

Activity (Go SEA)

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