In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 17 | Yes |
Popular Name: (2S)-N1-isopropyl-N2,N2-bis(2-methoxyethyl)butane-1,2-diamine (2S)-N1-isopropyl-N2,N2-bis(2-me…
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) | 1.64 | 3.15 | -29.04 | 2 | 4 | 1 | 38 | 247.403 | 11 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 1.94 | -2.62 | 1 | 4 | 0 | 34 | 246.395 | 11 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 4.85 | -97.67 | 3 | 4 | 2 | 40 | 248.411 | 11 | ↓ |