UCSF

ZINC17724771

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 24th, 2008 24 No

Popular Name: 6'-amino-3'-ethyl-1-methyl-1,2',3,4'-tetrahydro-2-oxospiro(2H-indole-3,4'-pyrano[2,3-c]pyrazole)-5'-carbonitrile 6'-amino-3'-ethyl-1-methyl-1,2',…

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD05241085

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) 1.32 1.42 -13.31 3 7 0 108 321.34 1 ↓
Ref Reference (pH 7) 1.32 2.08 -12.57 3 7 0 108 321.34 1 ↓

Activity (Go SEA)

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