In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (7S,8S)-N7-isopentyl-N7-methyl-1,4-dioxaspiro[4.5]decane-7,8-diamine (7S,8S)-N7-isopentyl-N7-methyl-1…
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) | 1.39 | 4.62 | -121.26 | 4 | 4 | 2 | 51 | 258.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 4.32 | -33.83 | 3 | 4 | 1 | 49 | 257.398 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 2.67 | -40.53 | 3 | 4 | 1 | 49 | 257.398 | 4 | ↓ |