In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 12 | Yes |
Popular Name: (2S)-1-amino-3-[cyclopentyl(methyl)amino]propan-2-ol (2S)-1-amino-3-[cyclopentyl(meth…
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) | -0.10 | 1.36 | -101.99 | 5 | 3 | 2 | 52 | 174.288 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.10 | 0.89 | -32.26 | 4 | 3 | 1 | 51 | 173.28 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.10 | 1.9 | -41.38 | 4 | 3 | 1 | 55 | 173.28 | 4 | ↓ |