UCSF

ZINC04110287

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 24 Yes

Other Names:

MFCD05670642

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) 4.91 11.43 -42.63 1 3 1 23 348.894 9
Hi High (pH 8-9.5) 4.91 9.76 -4.93 0 3 0 22 347.886 9

Vendor Notes

Note Type Comments Provided By
melting_point 0 KeyOrganics

Activity (Go SEA)

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