In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 15 | Yes |
Popular Name: (2S)-N-[(1S)-1-cyclopropylethyl]-N',N',4-trimethyl-pentane-1,2-diamine (2S)-N-[(1S)-1-cyclopropylethyl]…
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) | 2.97 | 5.83 | -32.63 | 2 | 2 | 1 | 20 | 213.389 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 7.98 | -30.3 | 2 | 2 | 1 | 16 | 213.389 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 7.68 | -113.17 | 3 | 2 | 2 | 21 | 214.397 | 7 | ↓ |