In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: (1S,2R)-2-(aminomethyl)-N-methyl-N-(3-pyridylmethyl)cyclopentanamine (1S,2R)-2-(aminomethyl)-N-methyl…
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) | 0.57 | 2.39 | -46.8 | 3 | 3 | 1 | 44 | 220.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.57 | 4.55 | -35.81 | 3 | 3 | 1 | 43 | 220.34 | 4 | ↓ |