In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: 2-[[4-(aminomethyl)-5,6-dimethyl-pyridazin-3-yl]-cyclopropyl-amino]ethanol 2-[[4-(aminomethyl)-5,6-dimethyl…
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) | 0.29 | 1.36 | -24.96 | 4 | 5 | 1 | 77 | 237.327 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.29 | 1.29 | -9.92 | 3 | 5 | 0 | 75 | 236.319 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.29 | 1.4 | -21.31 | 4 | 5 | 1 | 77 | 237.327 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.29 | 1.76 | -98.85 | 5 | 5 | 2 | 78 | 238.335 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.29 | 1.72 | -99.6 | 5 | 5 | 2 | 78 | 238.335 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.