UCSF

ZINC39797403

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2010 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) -3.96 -0.04 -100.92 7 9 1 156 284.296 7
Hi High (pH 8-9.5) -3.96 -0.81 -59.31 5 9 -1 153 282.28 7
Mid Mid (pH 6-8) -3.96 -0.47 -80.99 6 9 0 155 283.288 7

Vendor Notes

Note Type Comments Provided By
UniProt Database Links AGH_ARMVU; AGH_PORDI; AGH_PORSC ChEBI

Activity (Go SEA)

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