UCSF

ZINC36106864

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 18 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) 0.34 3.57 -15.22 1 5 0 53 255.362 4
Mid Mid (pH 6-8) 0.34 4.4 -45.1 2 5 1 54 256.37 4

Activity (Go SEA)

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