In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 16 | No |
Popular Name: 3-[[(1-methylcyclopentyl)amino]methyl]benzene-1,2-diol 3-[[(1-methylcyclopentyl)amino]m…
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) | 2.58 | 2.64 | -35.91 | 4 | 3 | 1 | 57 | 222.308 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 3.55 | -31.12 | 3 | 3 | 0 | 60 | 221.3 | 3 | ↓ |