In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 16 | Yes |
Popular Name: (1S,2R)-N2-(cyclopropylmethyl)-N2-methyl-indane-1,2-diamine (1S,2R)-N2-(cyclopropylmethyl)-N…
None
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) | 0.31 | 7.51 | -123.05 | 4 | 2 | 2 | 32 | 218.344 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.31 | 5.19 | -2.26 | 2 | 2 | 0 | 29 | 216.328 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.31 | 5.51 | -37.88 | 3 | 2 | 1 | 31 | 217.336 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.31 | 7.2 | -33.88 | 3 | 2 | 1 | 30 | 217.336 | 3 | ↓ |