UCSF

ZINC08828956

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 33 No

Other Names:

MFCD01315954

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) 2.65 6.03 -52.53 1 9 1 115 548.994 7

Vendor Notes

Note Type Comments Provided By
melting_point 182 - 185 KeyOrganics

Activity (Go SEA)

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