In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: (1R)-N-(2-dimethylaminoethyl)-1-(1-methylpyrazol-4-yl)-N-propyl-ethane-1,2-diamine (1R)-N-(2-dimethylaminoethyl)-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) | 0.02 | 3.3 | -107.13 | 4 | 5 | 2 | 53 | 255.41 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.02 | 0.85 | -46.46 | 3 | 5 | 1 | 52 | 254.402 | 8 | ↓ |