UCSF

ZINC19885891

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 20 Yes

Other Names:

MFCD12623320

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) 3.01 3.62 -16.03 3 4 0 61 290.75 4
Hi High (pH 8-9.5) 3.01 4.41 -46.01 2 4 -1 64 289.742 4

Activity (Go SEA)

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