UCSF

ZINC15317694

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2008 28 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) 2.51 7.48 -15.63 1 6 0 81 436.32 6
Lo Low (pH 4.5-6) 2.51 7.76 -54.15 2 6 1 82 437.328 6

Activity (Go SEA)

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