In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (2R)-N1,N1-diethyl-N2-[(1R)-1-methylheptyl]propane-1,2-diamine (2R)-N1,N1-diethyl-N2-[(1R)-1-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) | 4.49 | 8.51 | -30.17 | 2 | 2 | 1 | 20 | 243.459 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.49 | 8.97 | -30.62 | 2 | 2 | 1 | 16 | 243.459 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 10.15 | -106.35 | 3 | 2 | 2 | 21 | 244.467 | 11 | ↓ |