UCSF

ZINC34589534

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 12 No

Other Names:

F2147-0691

MFCD11101512

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) 1.61 3.87 -8.87 1 2 0 29 183.638 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4115575; US4195090; US4410530 IBM Patent Data

Activity (Go SEA)

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