In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 16 | Yes |
Popular Name: (2S)-N2-(cyclohexylmethyl)-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-(cyclohexylmethyl)-N1,N1…
None
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) | 3.50 | 6.99 | -32.97 | 2 | 2 | 1 | 20 | 227.416 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.50 | 7.81 | -31.6 | 2 | 2 | 1 | 16 | 227.416 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 9.03 | -111.48 | 3 | 2 | 2 | 21 | 228.424 | 7 | ↓ |