UCSF

ZINC02383825

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 16 Yes

Other Names:

MFCD01814763

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) 3.36 1.38 -46.33 0 3 -1 49 221.276 7

Vendor Notes

Note Type Comments Provided By
melting_point 84 - 88 KeyOrganics

Activity (Go SEA)

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