UCSF

ZINC23227774

Substance Information

In ZINC since Heavy atoms Benign functionality
December 28th, 2008 22 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) 2.80 5.8 -8.63 1 4 0 42 304.434 8
Mid Mid (pH 6-8) 2.80 8.07 -44.07 2 4 1 43 305.442 8

Activity (Go SEA)

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