In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1S,2R)-N2-cyclopropyl-1-(4-ethylphenyl)-N2-(2-methoxyethyl)-N1-methyl-propane-1,2-diamine (1S,2R)-N2-cyclopropyl-1-(4-ethy…
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) | 3.30 | 8.91 | -103.18 | 3 | 3 | 2 | 30 | 292.467 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.30 | 6.7 | -38.75 | 2 | 3 | 1 | 29 | 291.459 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.30 | 5.38 | -2.56 | 1 | 3 | 0 | 24 | 290.451 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 7.17 | -26.3 | 2 | 3 | 1 | 26 | 291.459 | 9 | ↓ |