In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | No |
Popular Name: (2S)-N2-(6-chloro-3-nitro-2-pyridyl)-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-(6-chloro-3-nitro-2-pyri…
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) | 2.94 | 8.62 | -34.01 | 2 | 6 | 1 | 75 | 287.771 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 6.41 | -4.66 | 1 | 6 | 0 | 74 | 286.763 | 7 | ↓ |