UCSF

ZINC00259984

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 Yes

Other Names:

MFCD01986020

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) 2.59 2.97 -10.21 1 5 0 65 277.301 3
Hi High (pH 8-9.5) 2.59 3.1 -44.15 0 5 -1 67 276.293 3

Activity (Go SEA)

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