In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 14 | Yes |
Popular Name: 2-[[(1R,2R)-2-(aminomethyl)cyclopentyl]-methyl-amino]-N-methyl-acetamide 2-[[(1R,2R)-2-(aminomethyl)cyclo…
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) | 0.02 | 1.58 | -106.19 | 5 | 4 | 2 | 61 | 201.314 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.02 | 1.2 | -36 | 4 | 4 | 1 | 60 | 200.306 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.02 | 0.12 | -46.35 | 4 | 4 | 1 | 60 | 200.306 | 4 | ↓ |