In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-N'-(cyclopropylmethyl)-N-ethyl-1-(4-isopropoxyphenyl)-N'-methyl-ethane-1,2-diamine (1S)-N'-(cyclopropylmethyl)-N-et…
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) | 3.75 | 10.48 | -122.55 | 3 | 3 | 2 | 30 | 292.467 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 8.56 | -35.61 | 2 | 3 | 1 | 29 | 291.459 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 9.45 | -35.19 | 2 | 3 | 1 | 26 | 291.459 | 9 | ↓ |