UCSF

ZINC39249926

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 12 No

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) 0.87 1.64 -4.4 2 3 0 60 183.594 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0086611A1; EP0086612A1; EP0087237A1; EP0088619A2; EP0089769A1; EP0092352A1; US4097489; US4100192; US4109082; US4112224; US4126744; US4128713; US4131738; US4151351; US4157441; US4160095; US4218378; US4220796; US4243592; US4275213; US4281113; US4289893; U IBM Patent Data

Activity (Go SEA)

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