UCSF

ZINC03128687

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 27 Yes

Other Names:

MFCD00215768

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) 2.43 -3.53 -18.28 2 7 0 101 394.424 9

Vendor Notes

Note Type Comments Provided By
melting_point 97 - 99 KeyOrganics

Activity (Go SEA)

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