UCSF

ZINC36159760

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 29 Yes

Popular Name: [cyclopropyl-[(2S)-3-(2-furylmethoxy)-2-hydroxy-propyl]amino]methylBLAHone [cyclopropyl-[(2S)-3-(2-furylmet…

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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) 1.87 7.55 -56.72 3 7 1 93 416.523 9 ↓
Hi High (pH 8-9.5) 2.33 4.66 -57.44 2 7 0 96 415.515 9 ↓
Hi High (pH 8-9.5) 1.87 5.19 -16.58 2 7 0 92 415.515 9 ↓

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