In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-N2-methyl-N2-[(2-methyl-3-furyl)methyl]pentane-1,2-diamine (2S)-N2-methyl-N2-[(2-methyl-3-f…
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) | 1.14 | 3.21 | -47.59 | 3 | 3 | 1 | 44 | 211.329 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.14 | 5.14 | -122.83 | 4 | 3 | 2 | 45 | 212.337 | 6 | ↓ |