In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 6th, 2011 | 20 | Yes |
Popular Name: 3-[5-[[cyclopentyl-[(1R)-1-methylpropyl]amino]methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[[cyclopentyl-[(1R)-1-methy…
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) | 3.74 | 8.35 | -34.69 | 2 | 2 | 1 | 25 | 292.468 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.74 | 6.73 | -6.06 | 1 | 2 | 0 | 23 | 291.46 | 5 | ↓ |