In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | No |
Popular Name: N',N'-diethyl-N-[(1S)-1-(3-nitrophenyl)propyl]propane-1,3-diamine N',N'-diethyl-N-[(1S)-1-(3-nitro…
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) | 2.64 | 9.52 | -39.62 | 2 | 5 | 1 | 62 | 294.419 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 8.62 | -51.65 | 2 | 5 | 1 | 66 | 294.419 | 10 | ↓ |