In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S)-N'-(cyclopropylmethyl)-1-(4-ethylphenyl)-N'-isopropyl-N-methyl-ethane-1,2-diamine (1S)-N'-(cyclopropylmethyl)-1-(4…
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) | 4.17 | 10.99 | -117.38 | 3 | 2 | 2 | 21 | 276.468 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.17 | 9.59 | -33.41 | 2 | 2 | 1 | 20 | 275.46 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.17 | 10.09 | -32.43 | 2 | 2 | 1 | 16 | 275.46 | 8 | ↓ |