In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R)-N'-(cyclopropylmethyl)-1-(3,4-dimethylphenyl)-N-ethyl-N'-isopropyl-ethane-1,2-diamine (1R)-N'-(cyclopropylmethyl)-1-(3…
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) | 4.45 | 11.53 | -110.83 | 3 | 2 | 2 | 21 | 290.495 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.45 | 10.32 | -32.98 | 2 | 2 | 1 | 16 | 289.487 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.45 | 10.25 | -31.65 | 2 | 2 | 1 | 20 | 289.487 | 8 | ↓ |