UCSF

ZINC01777932

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 25 No

Other Names:

MFCD02967301

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) 4.44 0.9 -10.01 1 5 0 56 341.407 8

Vendor Notes

Note Type Comments Provided By
melting_point 147 - 148 KeyOrganics

Activity (Go SEA)

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