UCSF

ZINC04247828

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 24 Yes

Other Names:

MFCD03478512

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) 3.16 8.11 -46.97 2 5 1 46 326.42 5
Mid Mid (pH 6-8) 3.16 5.97 -10.67 1 5 0 45 325.412 5

Vendor Notes

Note Type Comments Provided By
melting_point 139 - 140 KeyOrganics

Activity (Go SEA)

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