UCSF

ZINC16024389

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2008 21 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) 2.64 8.08 -10.18 1 4 0 46 299.761 3
Lo Low (pH 4.5-6) 2.64 8.58 -31.22 2 4 1 48 300.769 3

Activity (Go SEA)

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