UCSF

ZINC49580984

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 26 Yes

Popular Name: N-(2-furylmethyl)-2-[[(1R)-2-morpholino-1-(p-tolyl)ethyl]amino]acetamide N-(2-furylmethyl)-2-[[(1R)-2-mor…

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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) 2.27 4.58 -9.04 2 6 0 67 357.454 8 ↓
Mid Mid (pH 6-8) 2.27 5.33 -42.04 3 6 1 71 358.462 8 ↓
Lo Low (pH 4.5-6) 2.27 6.19 -40.11 3 6 1 68 358.462 8 ↓
Lo Low (pH 4.5-6) 2.27 7.23 -127.73 4 6 2 73 359.47 8 ↓

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