In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-N-isopropyl-1-(2-naphthyl)-N-propyl-ethane-1,2-diamine (1S)-N-isopropyl-1-(2-naphthyl)-…
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) | 3.46 | 8.69 | -124.95 | 4 | 2 | 2 | 32 | 272.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 7.54 | -46.93 | 3 | 2 | 1 | 31 | 271.428 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 8.33 | -30.16 | 3 | 2 | 1 | 30 | 271.428 | 6 | ↓ |