UCSF

ZINC36215685

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 25 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) 0.65 7.25 -67.85 2 9 -1 133 342.335 6
Mid Mid (pH 6-8) 0.64 8.49 -114.31 1 9 -2 131 341.327 6

Activity (Go SEA)

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