In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: 1-[[cyclopropyl(3-thienylmethyl)amino]methyl]cyclopentanamine 1-[[cyclopropyl(3-thienylmethyl)…
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 | 7.28 | -118.89 | 4 | 2 | 2 | 32 | 252.427 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 5.6 | -40.13 | 3 | 2 | 1 | 31 | 251.419 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 7.04 | -31.39 | 3 | 2 | 1 | 30 | 251.419 | 5 | ↓ |