In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 15 | Yes |
Popular Name: 3-[(5S)-3,7-diazaspiro[4.4]nonan-3-yl]-N,N-dimethyl-propan-1-amine 3-[(5S)-3,7-diazaspiro[4.4]nonan…
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) | 0.76 | 4.04 | -82.02 | 3 | 3 | 2 | 24 | 213.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.76 | 4.97 | -98.81 | 3 | 3 | 2 | 21 | 213.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.76 | 2.5 | -35.27 | 2 | 3 | 1 | 20 | 212.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 6.55 | -172.42 | 4 | 3 | 3 | 25 | 214.377 | 4 | ↓ |