UCSF

ZINC19866396

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 19 No

Other Names:

MFCD01559178

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) 1.45 6.1 -10.65 1 4 0 41 293.417 2
Hi High (pH 8-9.5) 1.91 5.68 -36.29 0 4 -1 44 292.409 2

Activity (Go SEA)

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