In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-N-cyclopropyl-1-(3-methoxyphenyl)-N-propyl-ethane-1,2-diamine (1S)-N-cyclopropyl-1-(3-methoxyp…
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) | 2.01 | 6.56 | -115.02 | 4 | 3 | 2 | 41 | 250.386 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 4.13 | -47.33 | 3 | 3 | 1 | 40 | 249.378 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 6.5 | -29.05 | 3 | 3 | 1 | 40 | 249.378 | 7 | ↓ |