In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1R)-N-(1-ethylpropyl)-1-(4-methoxyphenyl)-N-methyl-ethane-1,2-diamine (1R)-N-(1-ethylpropyl)-1-(4-meth…
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) | 2.53 | 4.95 | -130.35 | 4 | 3 | 2 | 41 | 252.402 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 4.52 | -43.94 | 3 | 3 | 1 | 40 | 251.394 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 6.02 | -29.06 | 3 | 3 | 1 | 40 | 251.394 | 7 | ↓ |