UCSF

ZINC62967081

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 19 Yes

Popular Name: (3S)-1-[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[3-(aminomethyl)imidazo[1…

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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) 1.10 6.6 -118.4 4 5 2 53 261.373 3 ↓
Hi High (pH 8-9.5) 1.10 3.82 -9.68 2 5 0 50 259.357 3 ↓
Mid Mid (pH 6-8) 1.10 4.22 -50.54 3 5 1 51 260.365 3 ↓

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

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