UCSF

ZINC19998142

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 26 No

Popular Name: (5Z)-1-(4-isopropylphenyl)-5-[(1-piperidylamino)methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-(4-isopropylphenyl)-5-[(1…

Find On: PubMed — Wikipedia — Google

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) 2.69 5.41 -47.83 1 7 -1 90 355.418 4 ↓
Lo Low (pH 4.5-6) 2.24 7.19 -8.4 2 7 0 87 356.426 4 ↓
Lo Low (pH 4.5-6) 2.69 6.72 -57.11 2 7 0 91 356.426 4 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.