UCSF

ZINC16577915

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 20 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) 3.58 5.17 -6.95 1 2 0 23 303.452 2
Mid Mid (pH 6-8) 3.58 8.13 -45.57 1 2 0 27 303.452 2

Activity (Go SEA)

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