UCSF

ZINC15415642

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2008 19 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.54 7.91 -8.14 0 3 0 32 251.333 2
Lo Low (pH 4.5-6) 2.54 10.04 -49.59 1 3 1 33 252.341 2

Activity (Go SEA)

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