In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 16 | Yes |
Popular Name: N',N'-dimethyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]-2-furyl]methyl]ethane-1,2-diamine N',N'-dimethyl-N-[[5-[(1R,2R)-2-…
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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) | 1.98 | 5.35 | -39.7 | 2 | 3 | 1 | 33 | 223.34 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 3.93 | -3.87 | 1 | 3 | 0 | 28 | 222.332 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 7.89 | -113.43 | 3 | 3 | 2 | 34 | 224.348 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 6.46 | -36.59 | 2 | 3 | 1 | 30 | 223.34 | 6 | ↓ |