UCSF

ZINC01406022

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 21 No

Other Names:

MFCD01568792

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) 3.03 -1.01 -12.96 1 5 0 63 348.2 5

Vendor Notes

Note Type Comments Provided By
melting_point 214 - 216 KeyOrganics

Activity (Go SEA)

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