In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2R)-N2-cyclopropyl-N2-(3-thienylmethyl)heptane-1,2-diamine (2R)-N2-cyclopropyl-N2-(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) | 2.93 | 6.85 | -47.56 | 3 | 2 | 1 | 31 | 267.462 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 8.33 | -125.56 | 4 | 2 | 2 | 32 | 268.47 | 9 | ↓ |