UCSF

ZINC34603705

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 27 Yes

Popular Name: 7-[(4S)-4-amino-4-methyl-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carbox 7-[(4S)-4-amino-4-methyl-6-azasp…

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) 1.42 10.5 -108.37 3 6 0 93 367.449 3 ↓
Mid Mid (pH 6-8) -1.33 7.7 -86.94 4 6 1 96 368.457 2 ↓

Activity (Go SEA)

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