UCSF

ZINC23331374

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 2008 35 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) 2.31 6.78 -15.64 0 8 0 73 508.591 6
Mid Mid (pH 6-8) 2.31 9 -51.9 1 8 1 75 509.599 6

Activity (Go SEA)

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