In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: (2S)-2-cyclopropyl-N2-methyl-N2-(4-pyridylmethyl)propane-1,2-diamine (2S)-2-cyclopropyl-N2-methyl-N2-…
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) | 0.56 | 4.92 | -121.86 | 4 | 3 | 2 | 45 | 221.348 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.56 | 2.99 | -42.8 | 3 | 3 | 1 | 44 | 220.34 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 4.48 | -32.65 | 3 | 3 | 1 | 43 | 220.34 | 5 | ↓ |