UCSF

ZINC15937649

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 19 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) 2.15 8.71 -12.97 0 3 0 25 314.501 3
Lo Low (pH 4.5-6) 2.15 8.01 -37.51 1 3 1 26 315.509 3

Activity (Go SEA)

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