UCSF

ZINC02541832

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 30 Yes

Other Names:

MFCD05150578

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) 6.60 1.26 -12.67 1 5 0 59 422.598 11

Vendor Notes

Note Type Comments Provided By
melting_point 130 - 132 KeyOrganics

Activity (Go SEA)

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