UCSF

ZINC01402137

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 24 Yes

Other Names:

MFCD03305448

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) 3.63 11.97 -14.67 0 3 0 25 318.42 3

Vendor Notes

Note Type Comments Provided By
melting_point 147 - 150 KeyOrganics

Activity (Go SEA)

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