UCSF

ZINC08970355

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 26 Yes

Other Names:

MFCD03767286

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) 3.45 6.5 -10.54 2 6 0 79 375.391 4
Hi High (pH 8-9.5) 3.07 4.82 -40.26 1 6 -1 85 374.383 4

Activity (Go SEA)

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