In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2R,3R)-N2-cyclopropyl-3-methyl-N2-(3-thienylmethyl)pentane-1,2-diamine (2R,3R)-N2-cyclopropyl-3-methyl-…
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) | 2.11 | 4.71 | -47.92 | 3 | 2 | 1 | 31 | 253.435 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 7.17 | -116.94 | 4 | 2 | 2 | 32 | 254.443 | 7 | ↓ |