In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: N'-methyl-N-[(1R)-1-methylpropyl]-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine N'-methyl-N-[(1R)-1-methylpropyl…
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) | 1.71 | 3.52 | -34.23 | 2 | 3 | 1 | 29 | 215.361 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.71 | 2.48 | -2.58 | 1 | 3 | 0 | 24 | 214.353 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 4.87 | -31.21 | 2 | 3 | 1 | 26 | 215.361 | 7 | ↓ |