UCSF

ZINC04014627

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 25 Yes

Other Names:

MFCD03012780

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) 3.22 1 -58.81 0 4 -1 60 330.363 4

Vendor Notes

Note Type Comments Provided By
melting_point 204 - 206 KeyOrganics

Activity (Go SEA)

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