In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N2-(cyclopropylmethyl)-N1-ethyl-N2-isopropyl-indane-1,2-diamine (1R,2S)-N2-(cyclopropylmethyl)-N…
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) | 3.61 | 10.6 | -110.71 | 3 | 2 | 2 | 21 | 274.452 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 8.16 | -1.82 | 1 | 2 | 0 | 15 | 272.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 9.45 | -32.31 | 2 | 2 | 1 | 16 | 273.444 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 9 | -31.2 | 2 | 2 | 1 | 20 | 273.444 | 6 | ↓ |