In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: (1S)-N-(1-ethylpropyl)-N-methyl-1-(2-naphthyl)ethane-1,2-diamine (1S)-N-(1-ethylpropyl)-N-methyl-…
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) | 3.66 | 8.27 | -123.52 | 4 | 2 | 2 | 32 | 272.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 7.39 | -43.97 | 3 | 2 | 1 | 31 | 271.428 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 7.92 | -30.2 | 3 | 2 | 1 | 30 | 271.428 | 6 | ↓ |