In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 15 | Yes |
Popular Name: 1-[[[(1S)-1-cyclopropylethyl]-methyl-amino]methyl]cyclohexanamine 1-[[[(1S)-1-cyclopropylethyl]-me…
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) | 2.93 | 6.5 | -115.91 | 4 | 2 | 2 | 32 | 212.381 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.93 | 4.72 | -38.07 | 3 | 2 | 1 | 31 | 211.373 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 7.03 | -28.6 | 3 | 2 | 1 | 30 | 211.373 | 4 | ↓ |