In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: (2S)-N2-cyclopropyl-3-ethyl-N2-isobutyl-pentane-1,2-diamine (2S)-N2-cyclopropyl-3-ethyl-N2-i…
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) | 2.75 | 6.94 | -116.58 | 4 | 2 | 2 | 32 | 228.424 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 5.88 | -41.94 | 3 | 2 | 1 | 31 | 227.416 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 6.12 | -27.58 | 3 | 2 | 1 | 30 | 227.416 | 8 | ↓ |