In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2R)-N1-cyclopropyl-N1-(3-thienylmethyl)butane-1,2-diamine (2R)-N1-cyclopropyl-N1-(3-thieny…
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) | 1.44 | 4.58 | -35.95 | 3 | 2 | 1 | 31 | 225.381 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 6.44 | -117.09 | 4 | 2 | 2 | 32 | 226.389 | 6 | ↓ |