UCSF

ZINC18117972

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2008 30 No

Popular Name: 5-[3-(allyloxy)phenyl]-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(5-methyl-2-furoyl)-1,5-dihydro-2H-pyrrol-2-one 5-[3-(allyloxy)phenyl]-1-[2-(dim…

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Other Names:

MFCD04148055

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) 2.56 9.71 -70.76 1 7 0 87 410.47 9 ↓
Lo Low (pH 4.5-6) 2.56 8.97 -47.12 2 7 1 84 411.478 9 ↓

Activity (Go SEA)

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