UCSF

ZINC52045221

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2010 16 Yes

Popular Name: (2S)-2-methyl-N-phenyl-piperidine-1-carboxamidine (2S)-2-methyl-N-phenyl-piperidin…

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Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -1.59 8.96 -24.77 3 3 1 41 218.324 2 ↓
Mid Mid (pH 6-8) 2.60 9.26 -4.84 2 3 0 42 217.316 2 ↓

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Rings

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

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