In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S)-N'-(cyclopropylmethyl)-1-(3,4-dimethylphenyl)-N'-methyl-N-propyl-ethane-1,2-diamine (1S)-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) | 4.28 | 11.61 | -121.07 | 3 | 2 | 2 | 21 | 276.468 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.56 | -33.08 | 2 | 2 | 1 | 16 | 275.46 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 9.67 | -33.18 | 2 | 2 | 1 | 20 | 275.46 | 8 | ↓ |