UCSF

ZINC78931518

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2012 19 Yes

Other Names:

MFCD27967416

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) -0.49 -3.63 -54.96 5 6 1 103 287.361 4
Mid Mid (pH 6-8) -0.49 -3.92 -10.86 4 6 0 102 286.353 4

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.