UCSF

ZINC15961507

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2008 29 No

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) 3.84 9.92 -60.89 0 5 -1 70 390.459 8
Lo Low (pH 4.5-6) 3.84 9.17 -13.7 1 5 0 67 391.467 8

Activity (Go SEA)

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