UCSF

ZINC12023857

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 33 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) 1.93 5.93 -63.32 2 9 1 106 496.993 8
Mid Mid (pH 6-8) 1.93 3.4 -26.58 1 9 0 105 495.985 8

Activity (Go SEA)

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