UCSF

ZINC03448206

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 23 Yes

Other Names:

MFCD05670550

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) 2.99 7.79 -9.74 1 4 0 51 304.349 5
Lo Low (pH 4.5-6) 2.99 8.24 -44.14 2 4 1 52 305.357 5

Activity (Go SEA)

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