UCSF

ZINC12858819

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2008 22 No

Other Names:

MFCD01315410

Download: MOL2 SDF SMILES Flexibase

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) 1.13 6.88 -18.03 0 6 0 67 302.33 3

Vendor Notes

Note Type Comments Provided By
melting_point 151 - 153 KeyOrganics

Activity (Go SEA)

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