In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: (1S)-N,N-diethyl-N'-(2-methoxyethyl)-1-phenyl-ethane-1,2-diamine (1S)-N,N-diethyl-N'-(2-methoxyet…
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) | 2.10 | 7.42 | -112.76 | 3 | 3 | 2 | 30 | 252.402 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 4 | -2.78 | 1 | 3 | 0 | 24 | 250.386 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 5.97 | -30.8 | 2 | 3 | 1 | 26 | 251.394 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 5.61 | -35.47 | 2 | 3 | 1 | 29 | 251.394 | 9 | ↓ |