UCSF

ZINC05964866

Substance Information

In ZINC since Heavy atoms Benign functionality
February 20th, 2006 17 Yes

CAS Number: 765-17-3

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) 6.20 9.28 -2.82 1 1 0 20 238.415 12

Vendor Notes

Note Type Comments Provided By
UniProt Database Links OR7A_DROME; PBP1_EPIPO; PBP2_EPIPO; PBP_BOMMO ChEBI
Patent Database Links US2007197628 ChEBI

Activity (Go SEA)

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