In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 18 | Yes |
Popular Name: (1R)-N',N'-dimethyl-N-[(1R)-1-(1-methylcyclopropyl)ethyl]-1-phenyl-ethane-1,2-diamine (1R)-N',N'-dimethyl-N-[(1R)-1-(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) | 2.86 | 9.84 | -108.74 | 3 | 2 | 2 | 21 | 248.414 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 9.37 | -38.02 | 2 | 2 | 1 | 16 | 247.406 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 8.18 | -29.28 | 2 | 2 | 1 | 20 | 247.406 | 6 | ↓ |