UCSF

ZINC52045502

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Substance Information

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

Popular Name: (3S)-3-methyl-N-phenyl-morpholine-4-carboxamidine (3S)-3-methyl-N-phenyl-morpholin…

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Download: MOL2 SDF SMILES Flexibase

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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) -2.65 6.77 -27.51 3 4 1 50 220.296 2 ↓
Mid Mid (pH 6-8) 1.54 6.82 -5.65 2 4 0 51 219.288 2 ↓

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

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