UCSF

ZINC06318106

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2006 27 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) 0.67 8.38 -66.35 1 8 -1 116 389.409 7

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0150984A2; EP0150984B1; EP0154444A1; EP0201221A1; EP0220939A1; EP0405316A2; EP0405316A3; EP0484870A2; EP0484870A3; EP0742015A1; US4223135; US4316016; US4316017; US4427678; US4452796; US4503040; US4591459; US4675186; US4762921; US4797394; US4826833; US48 IBM Patent Data

Activity (Go SEA)

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