UCSF

ZINC40036729

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 37 No

Popular Name: 3-allyl-2-[(N'E)-N'-[(4-butoxyphenyl)methylene]hydrazino]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexa 3-allyl-2-[(N'E)-N'-[(4-butoxyph…

Find On: PubMed — Wikipedia — Google

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) 7.05 18.51 -13.42 1 6 0 69 496.655 9 ↓
Lo Low (pH 4.5-6) 7.05 18.93 -30.28 2 6 1 70 497.663 9 ↓

Activity (Go SEA)

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