| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-N1-methyl-N1-[(2-methyl-3-furyl)methyl]pentane-1,2-diamine (2S)-N1-methyl-N1-[(2-methyl-3-f…
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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) | 1.21 | 5.77 | -123.3 | 4 | 3 | 2 | 45 | 212.337 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 5.47 | -36.16 | 3 | 3 | 1 | 44 | 211.329 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 3.82 | -41.67 | 3 | 3 | 1 | 44 | 211.329 | 6 | ↓ |
